4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide

C12H18N4O2 — CID 19396172

IUPAC4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide
SMILESCCCNC(=O)c1c(NC(=O)C2CC2)cnn1C
InChIInChI=1S/C12H18N4O2/c1-3-6-13-12(18)10-9(7-14-16(10)2)15-11(17)8-4-5-8/h7-8H,3-6H2,1-2H3,(H,13,18)(H,15,17)
InChIKeyMUJYSCVKLOHLQE-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.91
Rot. Bonds5

About 4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide

4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide (PubChem CID 19396172) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide.

Molecular Properties

Compound Name4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide
PubChem CID19396172
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide
SMILESCCCNC(=O)c1c(NC(=O)C2CC2)cnn1C
InChIInChI=1S/C12H18N4O2/c1-3-6-13-12(18)10-9(7-14-16(10)2)15-11(17)8-4-5-8/h7-8H,3-6H2,1-2H3,(H,13,18)(H,15,17)
InChIKeyMUJYSCVKLOHLQE-UHFFFAOYSA-N
XLogP0.91
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-4-[(2-methylbenzoyl)amino]-N-propylpyrazole-5-carboxamide
CID 4865439
4-[(2,5-dimethylbenzoyl)amino]-1-methyl-N-propylpyrazole-5-carboxamide
CID 19396369
(5R)-5-methyl-N-[1-methyl-5-(propylcarbamoyl)pyrazol-4-yl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
CID 51388341
(5S)-5-methyl-N-[1-methyl-5-(propylcarbamoyl)pyrazol-4-yl]-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
CID 51388342
1-[2-[[1-methyl-5-(propylcarbamoyl)pyrazol-4-yl]amino]-2-oxoethyl]pyrazole-4-carboxylic acid
CID 19502712
4-[[2-(4-chloro-5-methylpyrazol-1-yl)acetyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide
CID 19396300
2-[5-[[1-methyl-5-(propylcarbamoyl)pyrazol-4-yl]carbamoyl]pyrazol-1-yl]propanoic acid
CID 19487704
1-methyl-4-[[4-[(4-nitropyrazol-1-yl)methyl]benzoyl]amino]-N-propylpyrazole-5-carboxamide
CID 19396173
1-methyl-N-propyl-4-[[3-(pyrazol-1-ylmethyl)benzoyl]amino]pyrazole-5-carboxamide
CID 19396361
1-methyl-4-[[2-(3-methyl-4-nitropyrazol-1-yl)acetyl]amino]-N-propylpyrazole-5-carboxamide
CID 19396291
4-[[4-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]benzoyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide
CID 19396338
4-[[4-(difluoromethoxy)-3-methoxybenzoyl]amino]-1-methyl-N-propylpyrazole-5-carboxamide
CID 19396289

Frequently Asked Questions

What is the IUPAC name of 4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide?
The IUPAC name of 4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide (CID 19396172) is 4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide.
What is the SMILES notation for 4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide?
The canonical SMILES for 4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide is CCCNC(=O)c1c(NC(=O)C2CC2)cnn1C.
What is the InChIKey of 4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide?
The InChIKey is MUJYSCVKLOHLQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-3-6-13-12(18)10-9(7-14-16(10)2)15-11(17)8-4-5-8/h7-8H,3-6H2,1-2H3,(H,13,18)(H,15,17).
What are the key properties of 4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide?
4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide has a molecular weight of 250.30 g/mol, XLogP of 0.91, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(cyclopropanecarbonylamino)-1-methyl-N-propylpyrazole-5-carboxamide is sourced from PubChem (CID 19396172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).