4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide

C16H26N6O2 — CID 164639896

IUPAC4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide
SMILESCC(C)[C@H](NC(=O)N1CCC(n2cc(C(N)=O)nn2)CC1)C1CC1
InChIInChI=1S/C16H26N6O2/c1-10(2)14(11-3-4-11)18-16(24)21-7-5-12(6-8-21)22-9-13(15(17)23)19-20-22/h9-12,14H,3-8H2,1-2H3,(H2,17,23)(H,18,24)/t14-/m0/s1
InChIKeyCVSADXZWBABPOD-AWEZNQCLSA-N
MW334.42 g/mol
LogP1.16
Rot. Bonds5

About 4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide

4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide (PubChem CID 164639896) has the molecular formula C16H26N6O2 and a molecular weight of 334.42 g/mol. Its IUPAC name is 4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide
PubChem CID164639896
Molecular FormulaC16H26N6O2
Molecular Weight334.42 g/mol
Exact Mass334.21
IUPAC Name4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide
SMILESCC(C)[C@H](NC(=O)N1CCC(n2cc(C(N)=O)nn2)CC1)C1CC1
InChIInChI=1S/C16H26N6O2/c1-10(2)14(11-3-4-11)18-16(24)21-7-5-12(6-8-21)22-9-13(15(17)23)19-20-22/h9-12,14H,3-8H2,1-2H3,(H2,17,23)(H,18,24)/t14-/m0/s1
InChIKeyCVSADXZWBABPOD-AWEZNQCLSA-N
XLogP1.16
TPSA106.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(4-carbamoyltriazol-1-yl)-N-[(5-chlorothiophen-2-yl)methyl]piperidine-1-carboxamide
CID 126826858
1-(1-acetylpiperidin-4-yl)triazole-4-carbohydrazide
CID 135077480
4-(4-carbamoyltriazol-1-yl)-N-[(4R)-8-methyl-3,4-dihydro-2H-chromen-4-yl]piperidine-1-carboxamide
CID 154765242
N-propan-2-yl-4-[4-[1-(propan-2-ylamino)cyclopropyl]triazol-1-yl]piperidine-1-carboxamide
CID 156517320
1-[1-(1-methyltetrazol-5-yl)piperidin-4-yl]triazole-4-carboxamide
CID 154789313
1-(1-cyclopropyltriazol-4-yl)-2-methylpropan-1-one
CID 164754371
4-(3-aminopyrazol-1-yl)-N-propan-2-ylpiperidine-1-carboxamide
CID 107109443
1-[1-(pentan-3-ylcarbamoyl)azetidin-3-yl]triazole-4-carboxylic acid
CID 79309678
4-[4-(1,4-diazepan-1-ylmethyl)triazol-1-yl]-N-[(2R)-3-methylbutan-2-yl]piperidine-1-carboxamide
CID 30882220
1-[1-(1,3-benzodioxole-5-carbonyl)piperidin-4-yl]-N-propan-2-yltriazole-4-carboxamide
CID 42192175
1-[1-(tert-butylcarbamoyl)azetidin-3-yl]triazole-4-carboxylic acid
CID 79311077
tert-butyl 4-(4-methoxycarbonyltriazol-1-yl)piperidine-1-carboxylate
CID 119030830

Frequently Asked Questions

What is the IUPAC name of 4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide?
The IUPAC name of 4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide (CID 164639896) is 4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide.
What is the SMILES notation for 4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide?
The canonical SMILES for 4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide is CC(C)[C@H](NC(=O)N1CCC(n2cc(C(N)=O)nn2)CC1)C1CC1.
What is the InChIKey of 4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide?
The InChIKey is CVSADXZWBABPOD-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H26N6O2/c1-10(2)14(11-3-4-11)18-16(24)21-7-5-12(6-8-21)22-9-13(15(17)23)19-20-22/h9-12,14H,3-8H2,1-2H3,(H2,17,23)(H,18,24)/t14-/m0/s1.
What are the key properties of 4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide?
4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide has a molecular weight of 334.42 g/mol, XLogP of 1.16, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-carbamoyltriazol-1-yl)-N-[(1S)-1-cyclopropyl-2-methylpropyl]piperidine-1-carboxamide is sourced from PubChem (CID 164639896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).