N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide

C10H15N3O — CID 83619395

IUPACN-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide
SMILESO=C(NCC1CCCN1)c1cc[nH]c1
InChIInChI=1S/C10H15N3O/c14-10(8-3-5-11-6-8)13-7-9-2-1-4-12-9/h3,5-6,9,11-12H,1-2,4,7H2,(H,13,14)
InChIKeyCZPGHCBPQXERRD-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.50
Rot. Bonds3

About N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide

N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide (PubChem CID 83619395) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide.

Molecular Properties

Compound NameN-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide
PubChem CID83619395
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC NameN-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide
SMILESO=C(NCC1CCCN1)c1cc[nH]c1
InChIInChI=1S/C10H15N3O/c14-10(8-3-5-11-6-8)13-7-9-2-1-4-12-9/h3,5-6,9,11-12H,1-2,4,7H2,(H,13,14)
InChIKeyCZPGHCBPQXERRD-UHFFFAOYSA-N
XLogP0.50
TPSA56.92 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-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

N-(pyrrolidin-2-ylmethyl)naphthalene-2-carboxamide;hydrochloride
CID 119514272
4-benzamido-N-(pyrrolidin-2-ylmethyl)benzamide
CID 119513146
2-bromo-N-(pyrrolidin-2-ylmethyl)benzamide;hydrochloride
CID 119511017
4-(difluoromethylsulfanyl)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 119512475
3-chloro-4-hydroxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 62539853
3-(4-fluorophenyl)-N-[[(2S)-pyrrolidin-2-yl]methyl]benzamide;hydrochloride
CID 154911098
3-methoxy-4-methyl-N-(pyrrolidin-2-ylmethyl)benzamide;hydrochloride
CID 119509893
3-chloro-4-iodo-N-(pyrrolidin-2-ylmethyl)benzamide
CID 103806363
5-bromo-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide;hydrochloride
CID 119513668
2-hydroxy-6-oxo-N-(pyrrolidin-2-ylmethyl)-1H-pyridine-4-carboxamide
CID 62541095
4-butoxy-N-(pyrrolidin-2-ylmethyl)benzamide
CID 62542341
1-acetyl-N-(pyrrolidin-2-ylmethyl)-2,3-dihydroindole-5-carboxamide;hydrochloride
CID 119260434

Frequently Asked Questions

What is the IUPAC name of N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide?
The IUPAC name of N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide (CID 83619395) is N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide.
What is the SMILES notation for N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide?
The canonical SMILES for N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide is O=C(NCC1CCCN1)c1cc[nH]c1.
What is the InChIKey of N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide?
The InChIKey is CZPGHCBPQXERRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c14-10(8-3-5-11-6-8)13-7-9-2-1-4-12-9/h3,5-6,9,11-12H,1-2,4,7H2,(H,13,14).
What are the key properties of N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide?
N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide has a molecular weight of 193.25 g/mol, XLogP of 0.50, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyrrolidin-2-ylmethyl)-1H-pyrrole-3-carboxamide is sourced from PubChem (CID 83619395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).