N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide

C15H25N3O — CID 63961871

IUPACN-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncccc1C(=O)N(C)C(C)(C)CC
InChIInChI=1S/C15H25N3O/c1-6-10-16-13-12(9-8-11-17-13)14(19)18(5)15(3,4)7-2/h8-9,11H,6-7,10H2,1-5H3,(H,16,17)
InChIKeyDAPJTRLZCCLOIB-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.16
Rot. Bonds6

About N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide

N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide (PubChem CID 63961871) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide
PubChem CID63961871
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ncccc1C(=O)N(C)C(C)(C)CC
InChIInChI=1S/C15H25N3O/c1-6-10-16-13-12(9-8-11-17-13)14(19)18(5)15(3,4)7-2/h8-9,11H,6-7,10H2,1-5H3,(H,16,17)
InChIKeyDAPJTRLZCCLOIB-UHFFFAOYSA-N
XLogP3.16
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-butyl-N-methyl-2-(propylamino)pyridine-3-carboxamide
CID 62186071
2-amino-N-methyl-N-(2-methylbutan-2-yl)pyridine-3-carboxamide
CID 63961873
N-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide
CID 62168547
N-(2-chloro-3-pyridinyl)-N-methyl-2-(propylamino)pyridine-3-carboxamide
CID 19960025
2-(propylamino)pyridine-3-carboxylate
CID 22068597
N-(cyclopropylmethyl)-N-ethyl-2-(propylamino)pyridine-3-carboxamide
CID 63940110
N-methyl-N-(1-methylpiperidin-4-yl)-2-(propylamino)pyridine-3-carboxamide
CID 62165835
N-methyl-2-(propylamino)-N-(1,3-thiazol-4-ylmethyl)pyridine-3-carboxamide
CID 62179926
N-methyl-2-(propylamino)-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 62168156
N-methyl-2-(propylamino)-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 62169198
N-(2-methyl-2-methylsulfonylpropyl)-2-(propylamino)pyridine-3-carboxamide
CID 79557910
N-ethyl-N-(1-methoxypropan-2-yl)-2-(propylamino)pyridine-3-carboxamide
CID 62181530

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide (CID 63961871) is N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide is CCCNc1ncccc1C(=O)N(C)C(C)(C)CC.
What is the InChIKey of N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide?
The InChIKey is DAPJTRLZCCLOIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-6-10-16-13-12(9-8-11-17-13)14(19)18(5)15(3,4)7-2/h8-9,11H,6-7,10H2,1-5H3,(H,16,17).
What are the key properties of N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide?
N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 3.16, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-methylbutan-2-yl)-2-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 63961871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).