N-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide

C18H23N7O2 — CID 56708665

IUPACN-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide
SMILESO=C(NC1CC1)c1cn(C2CCN(C(=O)c3n[nH]c4c3CCC4)CC2)nn1
InChIInChI=1S/C18H23N7O2/c26-17(19-11-4-5-11)15-10-25(23-21-15)12-6-8-24(9-7-12)18(27)16-13-2-1-3-14(13)20-22-16/h10-12H,1-9H2,(H,19,26)(H,20,22)
InChIKeyTZRBBFUHAPOVIQ-UHFFFAOYSA-N
MW369.43 g/mol
LogP0.86
Rot. Bonds4

About N-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide

N-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide (PubChem CID 56708665) has the molecular formula C18H23N7O2 and a molecular weight of 369.43 g/mol. Its IUPAC name is N-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide
PubChem CID56708665
Molecular FormulaC18H23N7O2
Molecular Weight369.43 g/mol
Exact Mass369.19
IUPAC NameN-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide
SMILESO=C(NC1CC1)c1cn(C2CCN(C(=O)c3n[nH]c4c3CCC4)CC2)nn1
InChIInChI=1S/C18H23N7O2/c26-17(19-11-4-5-11)15-10-25(23-21-15)12-6-8-24(9-7-12)18(27)16-13-2-1-3-14(13)20-22-16/h10-12H,1-9H2,(H,19,26)(H,20,22)
InChIKeyTZRBBFUHAPOVIQ-UHFFFAOYSA-N
XLogP0.86
TPSA108.80 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide with MolForge

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Related Compounds

[4-(4-pyridin-4-yltriazol-1-yl)piperidin-1-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
CID 29150845
1-(1-cyclohexylpiperidin-4-yl)-N-cyclopropyltriazole-4-carboxamide
CID 26355434
N-[4-(4-methylpyrazol-1-yl)cyclohexyl]-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxamide
CID 175641935
1-[1-(3-chlorobenzoyl)piperidin-4-yl]-N-cyclopentyltriazole-4-carboxamide
CID 26361027
(4-imidazol-1-ylpiperidin-1-yl)-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-yl)methanone
CID 138993158
N-(1-acetylpiperidin-4-yl)-1-(azetidin-3-yl)triazole-4-carboxamide
CID 79318572
4-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonylamino)cyclohexane-1-carboxylic acid
CID 162632727
N-cyclopropyl-1-[1-(2-pyrazol-1-ylacetyl)piperidin-4-yl]triazole-4-carboxamide
CID 56703669
N-(4-aminocyclohexyl)-1-piperidin-4-yltriazole-4-carboxamide
CID 63284768
(4-phenylazepan-1-yl)-(1,4,5,6-tetrahydrocyclopenta[d]pyrazol-3-yl)methanone
CID 77090678
(3-aminopyrrolidin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
CID 112708550
(3-hydroxypiperidin-1-yl)-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
CID 110889660

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide?
The IUPAC name of N-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide (CID 56708665) is N-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide?
The canonical SMILES for N-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide is O=C(NC1CC1)c1cn(C2CCN(C(=O)c3n[nH]c4c3CCC4)CC2)nn1.
What is the InChIKey of N-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide?
The InChIKey is TZRBBFUHAPOVIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N7O2/c26-17(19-11-4-5-11)15-10-25(23-21-15)12-6-8-24(9-7-12)18(27)16-13-2-1-3-14(13)20-22-16/h10-12H,1-9H2,(H,19,26)(H,20,22).
What are the key properties of N-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide?
N-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide has a molecular weight of 369.43 g/mol, XLogP of 0.86, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-[1-(1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carbonyl)piperidin-4-yl]triazole-4-carboxamide is sourced from PubChem (CID 56708665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).