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

C14H21N3O2 — CID 55046881

IUPACN-(oxan-4-yl)-4-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccnc(C(=O)NC2CCOCC2)c1
InChIInChI=1S/C14H21N3O2/c1-2-6-15-12-3-7-16-13(10-12)14(18)17-11-4-8-19-9-5-11/h3,7,10-11H,2,4-6,8-9H2,1H3,(H,15,16)(H,17,18)
InChIKeyPVUOIBASTPDMGA-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.81
Rot. Bonds5

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

N-(oxan-4-yl)-4-(propylamino)pyridine-2-carboxamide (PubChem CID 55046881) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(oxan-4-yl)-4-(propylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(oxan-4-yl)-4-(propylamino)pyridine-2-carboxamide
PubChem CID55046881
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-(oxan-4-yl)-4-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccnc(C(=O)NC2CCOCC2)c1
InChIInChI=1S/C14H21N3O2/c1-2-6-15-12-3-7-16-13(10-12)14(18)17-11-4-8-19-9-5-11/h3,7,10-11H,2,4-6,8-9H2,1H3,(H,15,16)(H,17,18)
InChIKeyPVUOIBASTPDMGA-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

N-(4-ethylcyclohexyl)-4-(propylamino)pyridine-2-carboxamide
CID 63498977
N-cyclohexyl-4-(ethylamino)pyridine-2-carboxamide
CID 62171612
N-cyclopropyl-4-(3-methoxypropylamino)pyridine-2-carboxamide
CID 109201692
N-(2,2-dimethyloxan-4-yl)-4-(ethylamino)pyridine-2-carboxamide
CID 83039304
N-(2-oxopiperidin-3-yl)-4-(propylamino)pyridine-2-carboxamide
CID 62180055
N-(1,4-dioxan-2-ylmethyl)-4-(propylamino)pyridine-2-carboxamide
CID 62180963
N-(cyclohexylmethyl)-4-(propylamino)pyridine-2-carboxamide
CID 62169677
N-cycloheptyl-4-[3-(dimethylamino)propylamino]pyridine-2-carboxamide
CID 109207939
N-cyclopropyl-4-[(4-methylphenyl)methylamino]pyridine-2-carboxamide
CID 109201706
4-(methylamino)-N-(4-methylcyclohexyl)pyridine-2-carboxamide
CID 55042259
N-(2,6-difluorophenyl)-4-(propylamino)pyridine-2-carboxamide
CID 62165268
N-cyclopropyl-4-(furan-2-ylmethylamino)pyridine-2-carboxamide
CID 109201702

Frequently Asked Questions

What is the IUPAC name of N-(oxan-4-yl)-4-(propylamino)pyridine-2-carboxamide?
The IUPAC name of N-(oxan-4-yl)-4-(propylamino)pyridine-2-carboxamide (CID 55046881) is N-(oxan-4-yl)-4-(propylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(oxan-4-yl)-4-(propylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(oxan-4-yl)-4-(propylamino)pyridine-2-carboxamide is CCCNc1ccnc(C(=O)NC2CCOCC2)c1.
What is the InChIKey of N-(oxan-4-yl)-4-(propylamino)pyridine-2-carboxamide?
The InChIKey is PVUOIBASTPDMGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-2-6-15-12-3-7-16-13(10-12)14(18)17-11-4-8-19-9-5-11/h3,7,10-11H,2,4-6,8-9H2,1H3,(H,15,16)(H,17,18).
What are the key properties of N-(oxan-4-yl)-4-(propylamino)pyridine-2-carboxamide?
N-(oxan-4-yl)-4-(propylamino)pyridine-2-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-4-yl)-4-(propylamino)pyridine-2-carboxamide is sourced from PubChem (CID 55046881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).