4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide

C17H23N7O3 — CID 95747925

IUPAC4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide
SMILESCc1c(NC(=O)c2cc(NC(=O)C3CC3)n(C)n2)c(C(=O)N(C)C)nn1C
InChIInChI=1S/C17H23N7O3/c1-9-13(14(21-23(9)4)17(27)22(2)3)19-16(26)11-8-12(24(5)20-11)18-15(25)10-6-7-10/h8,10H,6-7H2,1-5H3,(H,18,25)(H,19,26)
InChIKeyMTQLJODTMKBQHM-UHFFFAOYSA-N
MW373.42 g/mol
LogP0.76
Rot. Bonds5

About 4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide

4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide (PubChem CID 95747925) has the molecular formula C17H23N7O3 and a molecular weight of 373.42 g/mol. Its IUPAC name is 4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide
PubChem CID95747925
Molecular FormulaC17H23N7O3
Molecular Weight373.42 g/mol
Exact Mass373.19
IUPAC Name4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide
SMILESCc1c(NC(=O)c2cc(NC(=O)C3CC3)n(C)n2)c(C(=O)N(C)C)nn1C
InChIInChI=1S/C17H23N7O3/c1-9-13(14(21-23(9)4)17(27)22(2)3)19-16(26)11-8-12(24(5)20-11)18-15(25)10-6-7-10/h8,10H,6-7H2,1-5H3,(H,18,25)(H,19,26)
InChIKeyMTQLJODTMKBQHM-UHFFFAOYSA-N
XLogP0.76
TPSA114.15 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide with MolForge

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Related Compounds

methyl 4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-1,5-dimethylpyrazole-3-carboxylate
CID 95748286
4-[(3,5-dichlorobenzoyl)amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide
CID 95748095
4-acetamido-N,N,1,5-tetramethylpyrazole-3-carboxamide
CID 95748088
5-(cyclohexanecarbonylamino)-N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-1-methylpyrazole-3-carboxamide
CID 51999836
5-(cyclopentanecarbonylamino)-1-methyl-N-propan-2-ylpyrazole-3-carboxamide
CID 51999563
5-(cyclopentanecarbonylamino)-1-methyl-N-(2-methylpropyl)pyrazole-3-carboxamide
CID 51999568
5-(cyclopropanecarbonylamino)-1-methyl-N-(1-pyridin-4-ylethyl)pyrazole-3-carboxamide
CID 56730214
4-[(3,6-dimethyl-1-benzofuran-2-carbonyl)amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide
CID 95747890
4-[[1-[(2,6-dichlorophenoxy)methyl]pyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide
CID 95747825
5-(cyclopentanecarbonylamino)-N-(1-ethylpyrazol-3-yl)-1-methylpyrazole-3-carboxamide
CID 51999721
methyl 4-(cyclopentanecarbonylamino)-1,5-dimethylpyrazole-3-carboxylate
CID 75358466
4-(2,3,4a,8a-tetrahydro-1,4-benzodioxine-3-carbonylamino)-N,N,1,5-tetramethylpyrazole-3-carboxamide
CID 110280670

Frequently Asked Questions

What is the IUPAC name of 4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide?
The IUPAC name of 4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide (CID 95747925) is 4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide.
What is the SMILES notation for 4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide?
The canonical SMILES for 4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide is Cc1c(NC(=O)c2cc(NC(=O)C3CC3)n(C)n2)c(C(=O)N(C)C)nn1C.
What is the InChIKey of 4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide?
The InChIKey is MTQLJODTMKBQHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N7O3/c1-9-13(14(21-23(9)4)17(27)22(2)3)19-16(26)11-8-12(24(5)20-11)18-15(25)10-6-7-10/h8,10H,6-7H2,1-5H3,(H,18,25)(H,19,26).
What are the key properties of 4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide?
4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide has a molecular weight of 373.42 g/mol, XLogP of 0.76, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[5-(cyclopropanecarbonylamino)-1-methylpyrazole-3-carbonyl]amino]-N,N,1,5-tetramethylpyrazole-3-carboxamide is sourced from PubChem (CID 95747925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).