2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide

C13H18N4O — CID 62161092

IUPAC2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)NC2CCN(C3CC3)C2)ccn1
InChIInChI=1S/C13H18N4O/c14-12-7-9(3-5-15-12)13(18)16-10-4-6-17(8-10)11-1-2-11/h3,5,7,10-11H,1-2,4,6,8H2,(H2,14,15)(H,16,18)
InChIKeyOMCFRCPQWRBRAY-UHFFFAOYSA-N
MW246.31 g/mol
LogP0.63
Rot. Bonds3

About 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide

2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide (PubChem CID 62161092) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide
PubChem CID62161092
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)NC2CCN(C3CC3)C2)ccn1
InChIInChI=1S/C13H18N4O/c14-12-7-9(3-5-15-12)13(18)16-10-4-6-17(8-10)11-1-2-11/h3,5,7,10-11H,1-2,4,6,8H2,(H2,14,15)(H,16,18)
InChIKeyOMCFRCPQWRBRAY-UHFFFAOYSA-N
XLogP0.63
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 50.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-cyclopentylpyridine-4-carboxamide
CID 62154850
N-(1-cyclopropylpyrrolidin-3-yl)-3,4-difluorobenzamide
CID 47938545
N-(1-cyclopropylpyrrolidin-3-yl)-3-methylbenzamide
CID 47938718
2-amino-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-4-carboxamide
CID 64667254
4-amino-3,5-dichloro-N-(1-cyclopropylpyrrolidin-3-yl)benzamide
CID 82833146
5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide
CID 81317228
2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide
CID 121352227
3-bromo-4-chloro-N-(1-cyclopropylpyrrolidin-3-yl)benzamide
CID 103841788
2-amino-N-(3-methylcyclohexyl)pyridine-4-carboxamide
CID 55042070
N-(1-cyclopropylpyrrolidin-3-yl)-3-(2-oxoimidazolidin-1-yl)benzamide
CID 51100170
N-[(3R)-1-cyclopropylpyrrolidin-3-yl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide
CID 94796962
4-amino-N-(1-cyclopropylpiperidin-4-yl)-3-methylbenzamide
CID 43711761

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide (CID 62161092) is 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide is Nc1cc(C(=O)NC2CCN(C3CC3)C2)ccn1.
What is the InChIKey of 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide?
The InChIKey is OMCFRCPQWRBRAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c14-12-7-9(3-5-15-12)13(18)16-10-4-6-17(8-10)11-1-2-11/h3,5,7,10-11H,1-2,4,6,8H2,(H2,14,15)(H,16,18).
What are the key properties of 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide?
2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide has a molecular weight of 246.31 g/mol, XLogP of 0.63, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide is sourced from PubChem (CID 62161092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).