2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide

C13H19N3O — CID 62161731

IUPAC2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide
SMILESCCCCN(C(=O)c1ccnc(N)c1)C1CC1
InChIInChI=1S/C13H19N3O/c1-2-3-8-16(11-4-5-11)13(17)10-6-7-15-12(14)9-10/h6-7,9,11H,2-5,8H2,1H3,(H2,14,15)
InChIKeyOXFKNKKFPVWTFN-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.07
Rot. Bonds5

About 2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide

2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide (PubChem CID 62161731) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide
PubChem CID62161731
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC Name2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide
SMILESCCCCN(C(=O)c1ccnc(N)c1)C1CC1
InChIInChI=1S/C13H19N3O/c1-2-3-8-16(11-4-5-11)13(17)10-6-7-15-12(14)9-10/h6-7,9,11H,2-5,8H2,1H3,(H2,14,15)
InChIKeyOXFKNKKFPVWTFN-UHFFFAOYSA-N
XLogP2.07
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[butyl(cyclopropyl)carbamoyl]pyridine-2-carboxylic acid
CID 113263115
2-amino-N-(3-methoxypropyl)-N-(1-methylpiperidin-4-yl)pyridine-4-carboxamide
CID 56890332
2-(aminomethyl)-N-cyclopropyl-N-propylpyridine-4-carboxamide
CID 113277725
2-amino-N-(1,1-dioxothiolan-3-yl)-N-ethylpyridine-4-carboxamide
CID 110853810
2-amino-N-(cyclopropylmethyl)-N-ethylpyridine-4-carboxamide
CID 63939345
2-amino-N-propan-2-yl-N-propylpyridine-4-carboxamide
CID 62156310
N-(3-aminopropyl)-N-cycloheptyl-2-methylpyridine-4-carboxamide
CID 106752285
N-butyl-N-cyclopropyl-3-hydroxypyridine-2-carboxamide
CID 61443052
N-(3-bromopropyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide
CID 106754316
N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide
CID 106754373
N-butyl-N-cyclopropyl-4-(ethylamino)-3-methylbenzamide
CID 63213660
N-cyclobutyl-N-(3-hydroxypropyl)-2-(methylamino)pyridine-4-carboxamide
CID 102870330

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide?
The IUPAC name of 2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide (CID 62161731) is 2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide is CCCCN(C(=O)c1ccnc(N)c1)C1CC1.
What is the InChIKey of 2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide?
The InChIKey is OXFKNKKFPVWTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-2-3-8-16(11-4-5-11)13(17)10-6-7-15-12(14)9-10/h6-7,9,11H,2-5,8H2,1H3,(H2,14,15).
What are the key properties of 2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide?
2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-butyl-N-cyclopropylpyridine-4-carboxamide is sourced from PubChem (CID 62161731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).