1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide

C16H19N5O — CID 50969158

IUPAC1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide
SMILESCC(C)C(NC(=O)c1cnn2ccn(C)c12)c1ccccn1
InChIInChI=1S/C16H19N5O/c1-11(2)14(13-6-4-5-7-17-13)19-15(22)12-10-18-21-9-8-20(3)16(12)21/h4-11,14H,1-3H3,(H,19,22)
InChIKeyWIVVTMFMCRTMEF-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.19
Rot. Bonds4

About 1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide

1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide (PubChem CID 50969158) has the molecular formula C16H19N5O and a molecular weight of 297.36 g/mol. Its IUPAC name is 1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide
PubChem CID50969158
Molecular FormulaC16H19N5O
Molecular Weight297.36 g/mol
Exact Mass297.16
IUPAC Name1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide
SMILESCC(C)C(NC(=O)c1cnn2ccn(C)c12)c1ccccn1
InChIInChI=1S/C16H19N5O/c1-11(2)14(13-6-4-5-7-17-13)19-15(22)12-10-18-21-9-8-20(3)16(12)21/h4-11,14H,1-3H3,(H,19,22)
InChIKeyWIVVTMFMCRTMEF-UHFFFAOYSA-N
XLogP2.19
TPSA64.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-N-[(1S)-2-methyl-1-pyridin-2-ylpropyl]imidazole-4-carboxamide
CID 125442338
N-[(1R)-1-pyridin-2-ylethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 39991149
N-(2-imidazol-1-yl-1-phenylethyl)-1-methylimidazo[2,1-e]pyrazole-7-carboxamide
CID 50982007
6-(aminomethyl)-2-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)pyridine-3-carboxamide;dihydrochloride
CID 86814402
5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide
CID 91790024
1-methyl-N-[[1-(phenoxymethyl)cyclopropyl]methyl]imidazo[2,1-e]pyrazole-7-carboxamide
CID 122567110
1-(hydroxymethyl)-N-(2-methyl-1-pyridin-2-ylpropyl)-3,4-dihydro-1H-isoquinoline-2-carboxamide
CID 75427125
(2R)-N-[(1S)-2-methyl-1-pyridin-2-ylpropyl]-2-pyridin-2-ylsulfanylpropanamide
CID 97079268
3,5-dimethyl-N-[2-[[(1S)-2-methyl-1-pyridin-2-ylpropyl]amino]-2-oxoethyl]benzamide
CID 95981391
N-[(2S)-2-methoxy-2-thiophen-2-ylethyl]-1-methylimidazo[2,1-e]pyrazole-7-carboxamide
CID 95134823
4-[6-(dimethylamino)pyrimidin-4-yl]-N-[(1S)-2-methyl-1-pyridin-2-ylpropyl]benzamide
CID 126447692
2-[(3S)-3-methyl-2,3-dihydroindol-1-yl]-N-[(1R)-2-methyl-1-pyridin-2-ylpropyl]-2-oxoacetamide
CID 95773587

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide?
The IUPAC name of 1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide (CID 50969158) is 1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide.
What is the SMILES notation for 1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide?
The canonical SMILES for 1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide is CC(C)C(NC(=O)c1cnn2ccn(C)c12)c1ccccn1.
What is the InChIKey of 1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide?
The InChIKey is WIVVTMFMCRTMEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O/c1-11(2)14(13-6-4-5-7-17-13)19-15(22)12-10-18-21-9-8-20(3)16(12)21/h4-11,14H,1-3H3,(H,19,22).
What are the key properties of 1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide?
1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide has a molecular weight of 297.36 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(2-methyl-1-pyridin-2-ylpropyl)imidazo[2,1-e]pyrazole-7-carboxamide is sourced from PubChem (CID 50969158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).