1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide

C14H23N5O — CID 130365391

IUPAC1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide
SMILESCC1CN(C(C)C)CC1NC(=O)c1cn(C2CC2)nn1
InChIInChI=1S/C14H23N5O/c1-9(2)18-6-10(3)12(7-18)15-14(20)13-8-19(17-16-13)11-4-5-11/h8-12H,4-7H2,1-3H3,(H,15,20)
InChIKeyPLCFEWGCWBTZFR-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.07
Rot. Bonds4

About 1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide

1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide (PubChem CID 130365391) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide.

Molecular Properties

Compound Name1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide
PubChem CID130365391
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide
SMILESCC1CN(C(C)C)CC1NC(=O)c1cn(C2CC2)nn1
InChIInChI=1S/C14H23N5O/c1-9(2)18-6-10(3)12(7-18)15-14(20)13-8-19(17-16-13)11-4-5-11/h8-12H,4-7H2,1-3H3,(H,15,20)
InChIKeyPLCFEWGCWBTZFR-UHFFFAOYSA-N
XLogP1.07
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide
CID 130365347
N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-5-propan-2-ylpyridazine-3-carboxamide
CID 130375933
2-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,3-oxazole-4-carboxamide
CID 130375891
5-cyclobutyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)pyridazine-3-carboxamide
CID 130365382
1-(1-cyclopropyltriazol-4-yl)-2-methylpropan-1-one
CID 164754371
1-cyclopropyl-N-[(3R,4R)-4-methyl-1-[(4-phenylmethoxyphenyl)methyl]pyrrolidin-3-yl]triazole-4-carboxamide
CID 130365326
5-cyano-N-[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-oxazole-3-carboxamide
CID 130386740
5-(azetidin-3-yl)-N-[(3R,4R)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-oxazole-3-carboxamide
CID 130386630
N-heptan-2-yl-1-piperidin-4-yltriazole-4-carboxamide
CID 63283433
5-(2,2-difluoroethyl)-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-oxazole-3-carboxamide
CID 130395401
1-cyclopropyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)triazole-4-carboxamide
CID 167917069
1-[4-(2,2-dimethylpropanoylamino)cyclohexyl]-N-propan-2-yltriazole-4-carboxamide
CID 42364382

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide?
The IUPAC name of 1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide (CID 130365391) is 1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide.
What is the SMILES notation for 1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide?
The canonical SMILES for 1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide is CC1CN(C(C)C)CC1NC(=O)c1cn(C2CC2)nn1.
What is the InChIKey of 1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide?
The InChIKey is PLCFEWGCWBTZFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-9(2)18-6-10(3)12(7-18)15-14(20)13-8-19(17-16-13)11-4-5-11/h8-12H,4-7H2,1-3H3,(H,15,20).
What are the key properties of 1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide?
1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.07, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-(4-methyl-1-propan-2-ylpyrrolidin-3-yl)triazole-4-carboxamide is sourced from PubChem (CID 130365391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).