N-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide

C13H21N3O — CID 113436690

IUPACN-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide
SMILESCCCn1cccc1C(=O)N[C@@H]1CCCNC1
InChIInChI=1S/C13H21N3O/c1-2-8-16-9-4-6-12(16)13(17)15-11-5-3-7-14-10-11/h4,6,9,11,14H,2-3,5,7-8,10H2,1H3,(H,15,17)/t11-/m1/s1
InChIKeyOCLPNQSBDLXIMG-LLVKDONJSA-N
MW235.33 g/mol
LogP1.38
Rot. Bonds4

About N-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide

N-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide (PubChem CID 113436690) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is N-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide.

Molecular Properties

Compound NameN-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide
PubChem CID113436690
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC NameN-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide
SMILESCCCn1cccc1C(=O)N[C@@H]1CCCNC1
InChIInChI=1S/C13H21N3O/c1-2-8-16-9-4-6-12(16)13(17)15-11-5-3-7-14-10-11/h4,6,9,11,14H,2-3,5,7-8,10H2,1H3,(H,15,17)/t11-/m1/s1
InChIKeyOCLPNQSBDLXIMG-LLVKDONJSA-N
XLogP1.38
TPSA46.06 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(3R)-piperidin-3-yl]-1-propylpyrrole-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

1-(2,2-difluoroethyl)-N-[(3S)-piperidin-3-yl]pyrrole-2-carboxamide
CID 104982418
N-(3-azabicyclo[3.1.0]hexan-6-yl)-1-propylpyrrole-2-carboxamide
CID 43639095
4-[(1-propylpyrrole-2-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 60808069
cis-(1R,3S)-3-[(1-propylpyrrole-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 106321385
2,6-dimethyl-N-piperidin-3-ylbenzamide
CID 114025985
1-methyl-2-oxo-N-piperidin-3-ylpyridine-3-carboxamide;hydrochloride
CID 119424588
N-piperidin-3-ylbenzamide
CID 22017045
4-bromo-1-ethyl-N-piperidin-3-ylpyrrole-2-carboxamide;hydrochloride
CID 119424531
N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]-1-propylpyrrole-2-carboxamide
CID 114010730
N-pyrrolidin-3-yl-1-(thiophen-2-ylmethyl)pyrrole-2-carboxamide;hydrochloride
CID 119454255
2,3-dihydroxy-N-piperidin-3-ylbenzamide
CID 114343480
N-[3-(hydroxymethyl)pentan-3-yl]-1-propylpyrrole-2-carboxamide
CID 62520316

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide?
The IUPAC name of N-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide (CID 113436690) is N-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide.
What is the SMILES notation for N-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide?
The canonical SMILES for N-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide is CCCn1cccc1C(=O)N[C@@H]1CCCNC1.
What is the InChIKey of N-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide?
The InChIKey is OCLPNQSBDLXIMG-LLVKDONJSA-N. The full InChI is InChI=1S/C13H21N3O/c1-2-8-16-9-4-6-12(16)13(17)15-11-5-3-7-14-10-11/h4,6,9,11,14H,2-3,5,7-8,10H2,1H3,(H,15,17)/t11-/m1/s1.
What are the key properties of N-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide?
N-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide has a molecular weight of 235.33 g/mol, XLogP of 1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-piperidin-3-yl]-1-propylpyrrole-2-carboxamide is sourced from PubChem (CID 113436690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).