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

C13H18N4O — CID 81317228

IUPAC5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide
SMILESNc1ccc(C(=O)NC2CCN(C3CC3)C2)nc1
InChIInChI=1S/C13H18N4O/c14-9-1-4-12(15-7-9)13(18)16-10-5-6-17(8-10)11-2-3-11/h1,4,7,10-11H,2-3,5-6,8,14H2,(H,16,18)
InChIKeyVLAHFABJZICNQE-UHFFFAOYSA-N
MW246.31 g/mol
LogP0.63
Rot. Bonds3

About 5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide

5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide (PubChem CID 81317228) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide
PubChem CID81317228
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide
SMILESNc1ccc(C(=O)NC2CCN(C3CC3)C2)nc1
InChIInChI=1S/C13H18N4O/c14-9-1-4-12(15-7-9)13(18)16-10-5-6-17(8-10)11-2-3-11/h1,4,7,10-11H,2-3,5-6,8,14H2,(H,16,18)
InChIKeyVLAHFABJZICNQE-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

5-(aminomethyl)-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide
CID 55231554
6-chloro-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide
CID 62233324
N-(1-cyclopropylpyrrolidin-3-yl)-2H-triazole-4-carboxamide
CID 47937761
N-(1-cyclopropylpyrrolidin-3-yl)-5-(ethylamino)pyrazine-2-carboxamide
CID 107374989
2-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-4-carboxamide
CID 62161092
5-amino-N-(3,5-dimethylcyclohexyl)pyridine-2-carboxamide
CID 81316470
2-(5-amino-2-pyridinyl)-N-(1-cyclopropylpiperidin-4-yl)acetamide
CID 107337839
N-(1-cyclopropylpyrrolidin-3-yl)-6-(propylamino)pyridazine-3-carboxamide
CID 62174598
4-amino-3,5-dichloro-N-(1-cyclopropylpyrrolidin-3-yl)benzamide
CID 82833146
N-(1-cyclopentylpyrrolidin-3-yl)-1,3-thiazole-4-carboxamide
CID 110462193
3-amino-2-chloro-N-(1-cyclopropylpyrrolidin-3-yl)benzamide
CID 112575801
N-(1-cyclopropylpyrrolidin-3-yl)-1-phenylpyrazole-3-carboxamide
CID 51100168

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide?
The IUPAC name of 5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide (CID 81317228) is 5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide?
The canonical SMILES for 5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide is Nc1ccc(C(=O)NC2CCN(C3CC3)C2)nc1.
What is the InChIKey of 5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide?
The InChIKey is VLAHFABJZICNQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c14-9-1-4-12(15-7-9)13(18)16-10-5-6-17(8-10)11-2-3-11/h1,4,7,10-11H,2-3,5-6,8,14H2,(H,16,18).
What are the key properties of 5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide?
5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-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 5-amino-N-(1-cyclopropylpyrrolidin-3-yl)pyridine-2-carboxamide is sourced from PubChem (CID 81317228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).