1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide

C14H18N4O — CID 118763338

IUPAC1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide
SMILESCCC(NC(=O)c1nccn1C)c1ccc(C)cn1
InChIInChI=1S/C14H18N4O/c1-4-11(12-6-5-10(2)9-16-12)17-14(19)13-15-7-8-18(13)3/h5-9,11H,4H2,1-3H3,(H,17,19)
InChIKeyPRBLKPVQSAUEEG-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.00
Rot. Bonds4

About 1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide

1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide (PubChem CID 118763338) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide.

Molecular Properties

Compound Name1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide
PubChem CID118763338
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide
SMILESCCC(NC(=O)c1nccn1C)c1ccc(C)cn1
InChIInChI=1S/C14H18N4O/c1-4-11(12-6-5-10(2)9-16-12)17-14(19)13-15-7-8-18(13)3/h5-9,11H,4H2,1-3H3,(H,17,19)
InChIKeyPRBLKPVQSAUEEG-UHFFFAOYSA-N
XLogP2.00
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-chloro-1,3-dimethyl-N-[(1S)-1-(5-methyl-2-pyridinyl)propyl]pyrazole-5-carboxamide
CID 126445579
N-[1-(5-methyl-2-pyridinyl)propyl]-2-methylsulfanylpyrimidine-5-carboxamide
CID 91791681
4-imidazol-1-yl-N-[1-(5-methyl-2-pyridinyl)propyl]butanamide
CID 118795733
2-cyano-N-[(1S)-1-(5-methyl-2-pyridinyl)propyl]benzamide
CID 124751193
N-[1-(5-methyl-2-pyridinyl)propyl]-4-(piperidin-1-ylmethyl)benzamide
CID 131939571
N-(2-ethylbutyl)-1-methylimidazole-2-carboxamide
CID 115646653
2-cyclopropyl-N-[(1S)-1-(5-methyl-2-pyridinyl)propyl]-6-oxo-1H-pyrimidine-5-carboxamide
CID 126443243
1-methyl-N-propylimidazole-2-carboxamide
CID 12006368
4-[(1-methylimidazol-2-yl)methoxy]-N-[(1R)-1-(4-methylphenyl)propyl]benzamide
CID 51952153
2-[4-(3-methylphenyl)piperazin-1-yl]-N-[1-(5-methyl-2-pyridinyl)propyl]acetamide
CID 118776776
N-[(2S)-6-hydroxy-6-methylheptan-2-yl]-1-methylimidazole-2-carboxamide
CID 164634011
1-(1-methylimidazol-2-yl)-3-(4-methylphenyl)pentane-1,4-dione
CID 86081819

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide?
The IUPAC name of 1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide (CID 118763338) is 1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide.
What is the SMILES notation for 1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide?
The canonical SMILES for 1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide is CCC(NC(=O)c1nccn1C)c1ccc(C)cn1.
What is the InChIKey of 1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide?
The InChIKey is PRBLKPVQSAUEEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-4-11(12-6-5-10(2)9-16-12)17-14(19)13-15-7-8-18(13)3/h5-9,11H,4H2,1-3H3,(H,17,19).
What are the key properties of 1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide?
1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[1-(5-methyl-2-pyridinyl)propyl]imidazole-2-carboxamide is sourced from PubChem (CID 118763338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).