N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide

C91H124F2N12O13S2 — CID 160901351

IUPACN-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide
SMILESC#CCNC(=O)c1cc(C(C)C)cnc1OC.CC(C)c1cncc(CS(=O)(=O)C(C)C)c1.CC(C)c1cncc(CS(=O)(=O)c2ccc(F)cc2F)c1.CCCNC(=O)c1cncc(C(C)C)c1.CCNC(=O)c1cncc(C(C)C)c1.COc1ncc(C(C)C)cc1C(=O)NC1CCOC1.COc1ncc(C(C)C)cc1C(=O)NCC1CC1
InChIInChI=1S/C15H15F2NO2S.C14H20N2O3.C14H20N2O2.C13H16N2O2.C12H18N2O.C12H19NO2S.C11H16N2O/c1-10(2)12-5-11(7-18-8-12)9-21(19,20)15-4-3-13(16)6-14(15)17;1-9(2)10-6-12(14(18-3)15-7-10)13(17)16-11-4-5-19-8-11;1-9(2)11-6-12(14(18-3)16-8-11)13(17)15-7-10-4-5-10;1-5-6-14-12(16)11-7-10(9(2)3)8-15-13(11)17-4;1-4-5-14-12(15)11-6-10(9(2)3)7-13-8-11;1-9(2)12-5-11(6-13-7-12)8-16(14,15)10(3)4;1-4-13-11(14)10-5-9(8(2)3)6-12-7-10/h3-8,10H,9H2,1-2H3;6-7,9,11H,4-5,8H2,1-3H3,(H,16,17);6,8-10H,4-5,7H2,1-3H3,(H,15,17);1,7-9H,6H2,2-4H3,(H,14,16);6-9H,4-5H2,1-3H3,(H,14,15);5-7,9-10H,8H2,1-4H3;5-8H,4H2,1-3H3,(H,13,14)
InChIKeySPNUVYJYOISETQ-UHFFFAOYSA-N
MW1696.19 g/mol
LogP15.95
Rot. Bonds28

About N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide

N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide (PubChem CID 160901351) has the molecular formula C91H124F2N12O13S2 and a molecular weight of 1696.19 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide
PubChem CID160901351
Molecular FormulaC91H124F2N12O13S2
Molecular Weight1696.19 g/mol
Exact Mass1694.88
IUPAC NameN-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide
SMILESC#CCNC(=O)c1cc(C(C)C)cnc1OC.CC(C)c1cncc(CS(=O)(=O)C(C)C)c1.CC(C)c1cncc(CS(=O)(=O)c2ccc(F)cc2F)c1.CCCNC(=O)c1cncc(C(C)C)c1.CCNC(=O)c1cncc(C(C)C)c1.COc1ncc(C(C)C)cc1C(=O)NC1CCOC1.COc1ncc(C(C)C)cc1C(=O)NCC1CC1
InChIInChI=1S/C15H15F2NO2S.C14H20N2O3.C14H20N2O2.C13H16N2O2.C12H18N2O.C12H19NO2S.C11H16N2O/c1-10(2)12-5-11(7-18-8-12)9-21(19,20)15-4-3-13(16)6-14(15)17;1-9(2)10-6-12(14(18-3)15-7-10)13(17)16-11-4-5-19-8-11;1-9(2)11-6-12(14(18-3)16-8-11)13(17)15-7-10-4-5-10;1-5-6-14-12(16)11-7-10(9(2)3)8-15-13(11)17-4;1-4-5-14-12(15)11-6-10(9(2)3)7-13-8-11;1-9(2)12-5-11(6-13-7-12)8-16(14,15)10(3)4;1-4-13-11(14)10-5-9(8(2)3)6-12-7-10/h3-8,10H,9H2,1-2H3;6-7,9,11H,4-5,8H2,1-3H3,(H,16,17);6,8-10H,4-5,7H2,1-3H3,(H,15,17);1,7-9H,6H2,2-4H3,(H,14,16);6-9H,4-5H2,1-3H3,(H,14,15);5-7,9-10H,8H2,1-4H3;5-8H,4H2,1-3H3,(H,13,14)
InChIKeySPNUVYJYOISETQ-UHFFFAOYSA-N
XLogP15.95
TPSA340.93 Ų
H-Bond Donors5
H-Bond Acceptors20
Rotatable Bonds28
Heavy Atoms120
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001696.19
LogP ≤ 515.95
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

N-(cyanomethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N,N-dimethyl-1-(5-propan-2-yl-3-pyridinyl)methanesulfonamide;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-methylsulfonyl-5-propan-2-ylpyridine;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide
CID 158337828
5-fluoro-2-(3-methylsulfanylphenoxy)-N-[1-(2-methylsulfonylacetyl)piperidin-4-yl]pyridine-3-carboxamide;5-fluoro-2-(3-methylsulfanylphenoxy)-N-piperidin-4-ylpyridine-3-carboxamide
CID 158657863
N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide
CID 158946474
N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide
CID 159317103

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide (CID 160901351) is N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide is C#CCNC(=O)c1cc(C(C)C)cnc1OC.CC(C)c1cncc(CS(=O)(=O)C(C)C)c1.CC(C)c1cncc(CS(=O)(=O)c2ccc(F)cc2F)c1.CCCNC(=O)c1cncc(C(C)C)c1.CCNC(=O)c1cncc(C(C)C)c1.COc1ncc(C(C)C)cc1C(=O)NC1CCOC1.COc1ncc(C(C)C)cc1C(=O)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide?
The InChIKey is SPNUVYJYOISETQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2NO2S.C14H20N2O3.C14H20N2O2.C13H16N2O2.C12H18N2O.C12H19NO2S.C11H16N2O/c1-10(2)12-5-11(7-18-8-12)9-21(19,20)15-4-3-13(16)6-14(15)17;1-9(2)10-6-12(14(18-3)15-7-10)13(17)16-11-4-5-19-8-11;1-9(2)11-6-12(14(18-3)16-8-11)13(17)15-7-10-4-5-10;1-5-6-14-12(16)11-7-10(9(2)3)8-15-13(11)17-4;1-4-5-14-12(15)11-6-10(9(2)3)7-13-8-11;1-9(2)12-5-11(6-13-7-12)8-16(14,15)10(3)4;1-4-13-11(14)10-5-9(8(2)3)6-12-7-10/h3-8,10H,9H2,1-2H3;6-7,9,11H,4-5,8H2,1-3H3,(H,16,17);6,8-10H,4-5,7H2,1-3H3,(H,15,17);1,7-9H,6H2,2-4H3,(H,14,16);6-9H,4-5H2,1-3H3,(H,14,15);5-7,9-10H,8H2,1-4H3;5-8H,4H2,1-3H3,(H,13,14).
What are the key properties of N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide?
N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide has a molecular weight of 1696.19 g/mol, XLogP of 15.95, 28 rotatable bonds, 5 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-5-propan-2-yl-N-prop-2-ynylpyridine-3-carboxamide;3-propan-2-yl-5-(propan-2-ylsulfonylmethyl)pyridine;5-propan-2-yl-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 160901351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).