N-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide

C14H21N3O2 — CID 63362128

IUPACN-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)NC2CCCOC2)ccn1
InChIInChI=1S/C14H21N3O2/c1-2-6-15-13-9-11(5-7-16-13)14(18)17-12-4-3-8-19-10-12/h5,7,9,12H,2-4,6,8,10H2,1H3,(H,15,16)(H,17,18)
InChIKeyJKZVVHDPJAEXON-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.81
Rot. Bonds5

About N-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide

N-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide (PubChem CID 63362128) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide
PubChem CID63362128
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cc(C(=O)NC2CCCOC2)ccn1
InChIInChI=1S/C14H21N3O2/c1-2-6-15-13-9-11(5-7-16-13)14(18)17-12-4-3-8-19-10-12/h5,7,9,12H,2-4,6,8,10H2,1H3,(H,15,16)(H,17,18)
InChIKeyJKZVVHDPJAEXON-UHFFFAOYSA-N
XLogP1.81
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-N-(oxan-4-yl)pyridine-4-carboxamide
CID 62170267
N-cyclopentyl-2-(ethylamino)pyridine-4-carboxamide
CID 62173243
3,5-difluoro-N-(oxan-3-yl)-4-(propylamino)benzamide
CID 63362445
N-[5-(cyclopropylcarbamoyl)-2-methylphenyl]-2-(propylamino)pyridine-4-carboxamide
CID 59761490
N-(2-methoxycyclopentyl)-2-(propylamino)pyridine-4-carboxamide
CID 62181644
N-methyl-2-(propylamino)pyridine-4-carboxamide
CID 62170975
2-methyl-N-(oxolan-3-yl)pyridine-4-carboxamide
CID 139360784
2-(4-methylpiperazin-1-yl)-N-[(3R)-oxan-3-yl]pyridine-4-carboxamide
CID 96526874
2-amino-N-[(3S)-oxolan-3-yl]pyridine-4-carboxamide
CID 121352227
N-butyl-2-(propylamino)pyridine-4-carboxamide
CID 62185279
N-[2-[cyclopropyl(methyl)amino]ethyl]-2-(propylamino)pyridine-4-carboxamide
CID 62979979
N-[(3-methylcyclopentyl)methyl]-2-(propylamino)pyridine-4-carboxamide
CID 107415245

Frequently Asked Questions

What is the IUPAC name of N-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide (CID 63362128) is N-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide is CCCNc1cc(C(=O)NC2CCCOC2)ccn1.
What is the InChIKey of N-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide?
The InChIKey is JKZVVHDPJAEXON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-2-6-15-13-9-11(5-7-16-13)14(18)17-12-4-3-8-19-10-12/h5,7,9,12H,2-4,6,8,10H2,1H3,(H,15,16)(H,17,18).
What are the key properties of N-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide?
N-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.81, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-3-yl)-2-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 63362128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).