N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide

C13H19N3O — CID 106754373

IUPACN-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide
SMILESCc1cc(C(=O)N(CCN)C2CCC2)ccn1
InChIInChI=1S/C13H19N3O/c1-10-9-11(5-7-15-10)13(17)16(8-6-14)12-3-2-4-12/h5,7,9,12H,2-4,6,8,14H2,1H3
InChIKeyBETZBERMKZDPHY-UHFFFAOYSA-N
MW233.31 g/mol
LogP1.34
Rot. Bonds4

About N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide

N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide (PubChem CID 106754373) has the molecular formula C13H19N3O and a molecular weight of 233.31 g/mol. Its IUPAC name is N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide
PubChem CID106754373
Molecular FormulaC13H19N3O
Molecular Weight233.31 g/mol
Exact Mass233.15
IUPAC NameN-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide
SMILESCc1cc(C(=O)N(CCN)C2CCC2)ccn1
InChIInChI=1S/C13H19N3O/c1-10-9-11(5-7-15-10)13(17)16(8-6-14)12-3-2-4-12/h5,7,9,12H,2-4,6,8,14H2,1H3
InChIKeyBETZBERMKZDPHY-UHFFFAOYSA-N
XLogP1.34
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-aminopropyl)-N-cycloheptyl-2-methylpyridine-4-carboxamide
CID 106752285
N-(3-bromopropyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide
CID 106754316
N-[(2Z)-2-amino-2-hydroxyiminoethyl]-N-cyclopentyl-2-methylpyridine-4-carboxamide
CID 106753961
N-(2-aminoethyl)-N-cyclopentyl-3-methylbenzamide
CID 55241758
N-(2-aminoethyl)-N-cyclopentyl-3-fluoro-4-methylbenzamide
CID 63755708
N-(2-aminoethyl)-N-cyclopentyl-3,5-dimethylbenzamide
CID 63755882
2-methyl-N-propyl-N-pyrrolidin-3-ylpyridine-4-carboxamide
CID 106753627
N-(2-aminoethyl)-2-methyl-N-propan-2-ylpyridine-4-carboxamide
CID 106752314
2-(aminomethyl)-N-cyclopropyl-N-propylpyridine-4-carboxamide
CID 113277725
N-cyclopentyl-N-[2-(dimethylamino)ethyl]-2-fluoropyridine-4-carboxamide
CID 60565522
N-cyclopentyl-2-hydrazinyl-N-(2-hydroxyethyl)pyridine-4-carboxamide
CID 55050933
N-cyclobutyl-N-(3-hydroxypropyl)-2-(methylamino)pyridine-4-carboxamide
CID 102870330

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide?
The IUPAC name of N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide (CID 106754373) is N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide?
The canonical SMILES for N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide is Cc1cc(C(=O)N(CCN)C2CCC2)ccn1.
What is the InChIKey of N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide?
The InChIKey is BETZBERMKZDPHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O/c1-10-9-11(5-7-15-10)13(17)16(8-6-14)12-3-2-4-12/h5,7,9,12H,2-4,6,8,14H2,1H3.
What are the key properties of N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide?
N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 1.34, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-N-cyclobutyl-2-methylpyridine-4-carboxamide is sourced from PubChem (CID 106754373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).