(2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide

C15H18N4O — CID 95596170

IUPAC(2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide
SMILESO=C(NCc1ccccn1)N1CCC[C@@H]1c1ccc[nH]1
InChIInChI=1S/C15H18N4O/c20-15(18-11-12-5-1-2-8-16-12)19-10-4-7-14(19)13-6-3-9-17-13/h1-3,5-6,8-9,14,17H,4,7,10-11H2,(H,18,20)/t14-/m1/s1
InChIKeyJXBHZSRUXGXDAK-CQSZACIVSA-N
MW270.34 g/mol
LogP2.46
Rot. Bonds3

About (2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide

(2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide (PubChem CID 95596170) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is (2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound Name(2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide
PubChem CID95596170
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name(2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide
SMILESO=C(NCc1ccccn1)N1CCC[C@@H]1c1ccc[nH]1
InChIInChI=1S/C15H18N4O/c20-15(18-11-12-5-1-2-8-16-12)19-10-4-7-14(19)13-6-3-9-17-13/h1-3,5-6,8-9,14,17H,4,7,10-11H2,(H,18,20)/t14-/m1/s1
InChIKeyJXBHZSRUXGXDAK-CQSZACIVSA-N
XLogP2.46
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide
CID 47256655
(2R)-N-(pyridin-4-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide
CID 95604428
(2R)-N-[(1-cyclopropylcyclobutyl)methyl]-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide
CID 99634075
2-(1H-pyrrol-2-yl)-N-quinolin-8-ylpyrrolidine-1-carboxamide
CID 48791386
1-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]butane-1,3-dione
CID 60951109
N-[2-(2-methylpiperidin-1-yl)ethyl]-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide
CID 48791325
2,3-dihydro-1H-indol-2-yl-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]methanone
CID 76894849
(2-phenyl-1,3-thiazol-5-yl)-[(2R)-2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]methanone
CID 94773926
N-propyl-2-pyridin-2-ylpyrrolidine-1-carboxamide
CID 47386252
3-phenyl-1-[2-(1H-pyrrol-2-yl)pyrrolidin-1-yl]propan-1-one
CID 47028466
2-[1-(pyridin-2-ylmethylcarbamoyl)piperidin-3-yl]acetic acid
CID 62689961
2-[2-(1-acetylpyrrolidin-2-yl)pyrrolidin-1-yl]-N-(pyridin-2-ylmethyl)acetamide
CID 56803059

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide?
The IUPAC name of (2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide (CID 95596170) is (2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for (2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for (2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide is O=C(NCc1ccccn1)N1CCC[C@@H]1c1ccc[nH]1.
What is the InChIKey of (2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide?
The InChIKey is JXBHZSRUXGXDAK-CQSZACIVSA-N. The full InChI is InChI=1S/C15H18N4O/c20-15(18-11-12-5-1-2-8-16-12)19-10-4-7-14(19)13-6-3-9-17-13/h1-3,5-6,8-9,14,17H,4,7,10-11H2,(H,18,20)/t14-/m1/s1.
What are the key properties of (2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide?
(2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(pyridin-2-ylmethyl)-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 95596170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).