4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide

C15H25N3O — CID 54932690

IUPAC4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide
SMILESCC(C)n1cc(N)cc1C(=O)NCCC1CCCC1
InChIInChI=1S/C15H25N3O/c1-11(2)18-10-13(16)9-14(18)15(19)17-8-7-12-5-3-4-6-12/h9-12H,3-8,16H2,1-2H3,(H,17,19)
InChIKeyPKNVCHLBVLVJPY-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.96
Rot. Bonds5

About 4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide

4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide (PubChem CID 54932690) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide
PubChem CID54932690
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide
SMILESCC(C)n1cc(N)cc1C(=O)NCCC1CCCC1
InChIInChI=1S/C15H25N3O/c1-11(2)18-10-13(16)9-14(18)15(19)17-8-7-12-5-3-4-6-12/h9-12H,3-8,16H2,1-2H3,(H,17,19)
InChIKeyPKNVCHLBVLVJPY-UHFFFAOYSA-N
XLogP2.96
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-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

5-(2-cyclobutylethylcarbamoyl)-1-propan-2-ylpyrrole-3-sulfonyl chloride
CID 114611549
2-cyclobutylethyl 4-amino-1-propan-2-ylpyrrole-2-carboxylate
CID 114157735
4-amino-N-(oxan-2-ylmethyl)-1-propan-2-ylpyrrole-2-carboxamide
CID 55014453
4-chloro-N-(2-piperidin-3-ylethyl)-1-propan-2-ylpyrrole-2-carboxamide
CID 63628711
4-amino-N-[2-[methyl(propan-2-yl)amino]ethyl]-1-propan-2-ylpyrrole-2-carboxamide
CID 62636228
4-amino-N-[(1-methylpyrazol-4-yl)methyl]-1-propan-2-ylpyrrole-2-carboxamide
CID 61351154
4-amino-N-cyclopentyl-N-methyl-1-propan-2-ylpyrrole-2-carboxamide
CID 43643422
4-amino-N-(2-methyl-2-methylsulfonylpropyl)-1-propan-2-ylpyrrole-2-carboxamide
CID 79552297
4-amino-N-(2-methyl-3-pyrrolidin-1-ylpropyl)-1-propan-2-ylpyrrole-2-carboxamide
CID 62994297
4-amino-N-(1-ethylpiperidin-4-yl)-1-propan-2-ylpyrrole-2-carboxamide
CID 61139289
4-amino-N-[2-(1-methyl-1,2,4-triazol-3-yl)ethyl]-1-propan-2-ylpyrrole-2-carboxamide
CID 80681128
4-amino-N-(3,5-dimethylcyclohexyl)-1-propan-2-ylpyrrole-2-carboxamide
CID 64733030

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide?
The IUPAC name of 4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide (CID 54932690) is 4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide.
What is the SMILES notation for 4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide?
The canonical SMILES for 4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide is CC(C)n1cc(N)cc1C(=O)NCCC1CCCC1.
What is the InChIKey of 4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide?
The InChIKey is PKNVCHLBVLVJPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-11(2)18-10-13(16)9-14(18)15(19)17-8-7-12-5-3-4-6-12/h9-12H,3-8,16H2,1-2H3,(H,17,19).
What are the key properties of 4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide?
4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 2.96, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-cyclopentylethyl)-1-propan-2-ylpyrrole-2-carboxamide is sourced from PubChem (CID 54932690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).