N,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide

C18H20N2O — CID 171134567

IUPACN,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide
SMILESCc1cc(C(=O)N(C)CC=Cc2ccccc2)cnc1C
InChIInChI=1S/C18H20N2O/c1-14-12-17(13-19-15(14)2)18(21)20(3)11-7-10-16-8-5-4-6-9-16/h4-10,12-13H,11H2,1-3H3
InChIKeyOXWLNNDDJMOPOY-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.48
Rot. Bonds4

About N,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide

N,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide (PubChem CID 171134567) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is N,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide
PubChem CID171134567
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC NameN,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide
SMILESCc1cc(C(=O)N(C)CC=Cc2ccccc2)cnc1C
InChIInChI=1S/C18H20N2O/c1-14-12-17(13-19-15(14)2)18(21)20(3)11-7-10-16-8-5-4-6-9-16/h4-10,12-13H,11H2,1-3H3
InChIKeyOXWLNNDDJMOPOY-UHFFFAOYSA-N
XLogP3.48
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-(methylamino)-N-(3-phenylprop-2-enyl)pyrimidine-5-carboxamide
CID 171134990
N-methoxy-N,5,6-trimethylpyridine-3-carboxamide
CID 130211578
N,N-bis[(E)-3-phenylprop-2-enyl]benzamide
CID 139601549
N,5-dimethyl-N-[(E)-3-phenylprop-2-enyl]-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 77086526
N-(2-hydroxyethyl)-4-methyl-N-(3-phenylprop-2-enyl)pyrimidine-5-carboxamide
CID 171134622
ethyl 2-[methyl(3-phenylprop-2-enyl)amino]acetate
CID 76932222
dimethylamino (E)-5-phenylpent-4-enoate
CID 174423096
N-[(E)-3-phenylprop-2-enyl]-N-propyl-2-pyridin-3-ylpyrimidine-5-carboxamide
CID 50961931
N-ethyl-2-methyl-N-[(E)-3-phenylprop-2-enyl]-1,8-naphthyridine-3-carboxamide
CID 50970090
N-methyl-N-[(E)-3-phenylprop-2-enyl]formamide
CID 122392912
1,2-dimethyl-1-[(E)-3-phenylprop-2-enyl]hydrazine
CID 137382786
3-(5,6-dimethyl-3-pyridinyl)-3-oxopropanenitrile
CID 130438969

Frequently Asked Questions

What is the IUPAC name of N,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide?
The IUPAC name of N,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide (CID 171134567) is N,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide.
What is the SMILES notation for N,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide?
The canonical SMILES for N,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide is Cc1cc(C(=O)N(C)CC=Cc2ccccc2)cnc1C.
What is the InChIKey of N,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide?
The InChIKey is OXWLNNDDJMOPOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c1-14-12-17(13-19-15(14)2)18(21)20(3)11-7-10-16-8-5-4-6-9-16/h4-10,12-13H,11H2,1-3H3.
What are the key properties of N,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide?
N,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide has a molecular weight of 280.37 g/mol, XLogP of 3.48, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,5,6-trimethyl-N-(3-phenylprop-2-enyl)pyridine-3-carboxamide is sourced from PubChem (CID 171134567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).