N-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide

C16H24N4O — CID 62275462

IUPACN-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide
SMILESCCNC(=O)c1cc(N2CCCC2C2CCCN2)ccn1
InChIInChI=1S/C16H24N4O/c1-2-17-16(21)14-11-12(7-9-19-14)20-10-4-6-15(20)13-5-3-8-18-13/h7,9,11,13,15,18H,2-6,8,10H2,1H3,(H,17,21)
InChIKeyJCFITAATMIVARW-UHFFFAOYSA-N
MW288.39 g/mol
LogP1.55
Rot. Bonds4

About N-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide

N-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide (PubChem CID 62275462) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is N-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide
PubChem CID62275462
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC NameN-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide
SMILESCCNC(=O)c1cc(N2CCCC2C2CCCN2)ccn1
InChIInChI=1S/C16H24N4O/c1-2-17-16(21)14-11-12(7-9-19-14)20-10-4-6-15(20)13-5-3-8-18-13/h7,9,11,13,15,18H,2-6,8,10H2,1H3,(H,17,21)
InChIKeyJCFITAATMIVARW-UHFFFAOYSA-N
XLogP1.55
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-4-[2-(hydroxymethyl)pyrrolidin-1-yl]pyridine-2-carboxamide
CID 61409376
4-[(4aS,7aS)-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridin-6-yl]-N-ethylpyridine-2-carboxamide
CID 102683782
4-[2-(2-aminoethyl)piperidin-1-yl]-N-ethylpyridine-2-carboxamide
CID 63766258
N-ethyl-4-[2-[1-(methylamino)ethyl]piperidin-1-yl]pyridine-2-carboxamide
CID 63854741
N-ethyl-4-(3-hydroxypiperidin-1-yl)pyridine-2-carboxamide
CID 60551992
4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine
CID 62274954
1-[2-(ethylcarbamoyl)-4-pyridinyl]-2-methylpiperidine-4-carboxylic acid
CID 106742554
N-ethyl-4-[(2-methylpiperidin-3-yl)amino]pyridine-2-carboxamide
CID 114695697
4-(2,5-diethylpiperazin-1-yl)-N-ethylpyridine-2-carboxamide
CID 64979161
1-[2-(ethylcarbamoyl)-4-pyridinyl]pyrrolidine-3-carboxylic acid
CID 63032016
4-[2-(ethylcarbamoyl)-4-pyridinyl]thiomorpholine-3-carboxylic acid
CID 82901293
N-ethyl-4-[(2-oxopiperidin-3-yl)amino]pyridine-2-carboxamide
CID 55033632

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide?
The IUPAC name of N-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide (CID 62275462) is N-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide.
What is the SMILES notation for N-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide?
The canonical SMILES for N-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide is CCNC(=O)c1cc(N2CCCC2C2CCCN2)ccn1.
What is the InChIKey of N-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide?
The InChIKey is JCFITAATMIVARW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c1-2-17-16(21)14-11-12(7-9-19-14)20-10-4-6-15(20)13-5-3-8-18-13/h7,9,11,13,15,18H,2-6,8,10H2,1H3,(H,17,21).
What are the key properties of N-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide?
N-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide has a molecular weight of 288.39 g/mol, XLogP of 1.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(2-pyrrolidin-2-ylpyrrolidin-1-yl)pyridine-2-carboxamide is sourced from PubChem (CID 62275462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).