N-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide

C10H15N3O — CID 82491181

IUPACN-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide
SMILESO=C(NCc1cc[nH]c1)C1CCCN1
InChIInChI=1S/C10H15N3O/c14-10(9-2-1-4-12-9)13-7-8-3-5-11-6-8/h3,5-6,9,11-12H,1-2,4,7H2,(H,13,14)
InChIKeyIMEPJCPLSHJCIX-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.38
Rot. Bonds3

About N-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide

N-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide (PubChem CID 82491181) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is N-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound NameN-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide
PubChem CID82491181
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC NameN-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide
SMILESO=C(NCc1cc[nH]c1)C1CCCN1
InChIInChI=1S/C10H15N3O/c14-10(9-2-1-4-12-9)13-7-8-3-5-11-6-8/h3,5-6,9,11-12H,1-2,4,7H2,(H,13,14)
InChIKeyIMEPJCPLSHJCIX-UHFFFAOYSA-N
XLogP0.38
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 ≤ 50.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-(1H-pyrrol-3-ylmethyl)piperidine-2-carboxamide
CID 106384933
N-[(4-ethylphenyl)methyl]pyrrolidine-2-carboxamide
CID 82128917
N-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide
CID 43094683
N-(1H-pyrrol-3-ylmethyl)cycloheptanecarboxamide
CID 106385859
4-[(pyrrolidine-2-carbonylamino)methyl]benzoic acid
CID 61156861
N-[(4-tert-butylphenyl)methyl]pyrrolidine-2-carboxamide
CID 82132903
(2S)-N-[(4-cyanophenyl)methyl]pyrrolidine-2-carboxamide
CID 15391796
N-[(4-fluorophenyl)methyl]piperidine-2-carboxamide
CID 11615609
N-benzylpiperidine-2-carboxamide;hydrochloride
CID 53410820
N-[(3,4-dimethylphenyl)methyl]pyrrolidine-2-carboxamide
CID 82495808
(2S)-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyrrolidine-2-carboxamide;dihydrochloride
CID 119836228
N-(1H-pyrrol-3-yl)pyrrolidine-2-carboxamide
CID 115159173

Frequently Asked Questions

What is the IUPAC name of N-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide?
The IUPAC name of N-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide (CID 82491181) is N-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for N-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for N-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide is O=C(NCc1cc[nH]c1)C1CCCN1.
What is the InChIKey of N-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide?
The InChIKey is IMEPJCPLSHJCIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c14-10(9-2-1-4-12-9)13-7-8-3-5-11-6-8/h3,5-6,9,11-12H,1-2,4,7H2,(H,13,14).
What are the key properties of N-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide?
N-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide has a molecular weight of 193.25 g/mol, XLogP of 0.38, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-pyrrol-3-ylmethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 82491181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).