6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide

C13H19N3O2 — CID 64574041

IUPAC6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide
SMILESNC(=O)c1ccc(OCC2(N)CCCCC2)nc1
InChIInChI=1S/C13H19N3O2/c14-12(17)10-4-5-11(16-8-10)18-9-13(15)6-2-1-3-7-13/h4-5,8H,1-3,6-7,9,15H2,(H2,14,17)
InChIKeyBZSJQWUAHKNBBK-UHFFFAOYSA-N
MW249.31 g/mol
LogP1.22
Rot. Bonds4

About 6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide

6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide (PubChem CID 64574041) has the molecular formula C13H19N3O2 and a molecular weight of 249.31 g/mol. Its IUPAC name is 6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide
PubChem CID64574041
Molecular FormulaC13H19N3O2
Molecular Weight249.31 g/mol
Exact Mass249.15
IUPAC Name6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide
SMILESNC(=O)c1ccc(OCC2(N)CCCCC2)nc1
InChIInChI=1S/C13H19N3O2/c14-12(17)10-4-5-11(16-8-10)18-9-13(15)6-2-1-3-7-13/h4-5,8H,1-3,6-7,9,15H2,(H2,14,17)
InChIKeyBZSJQWUAHKNBBK-UHFFFAOYSA-N
XLogP1.22
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide?
The IUPAC name of 6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide (CID 64574041) is 6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide.
What is the SMILES notation for 6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide?
The canonical SMILES for 6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide is NC(=O)c1ccc(OCC2(N)CCCCC2)nc1.
What is the InChIKey of 6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide?
The InChIKey is BZSJQWUAHKNBBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2/c14-12(17)10-4-5-11(16-8-10)18-9-13(15)6-2-1-3-7-13/h4-5,8H,1-3,6-7,9,15H2,(H2,14,17).
What are the key properties of 6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide?
6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 1.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1-aminocyclohexyl)methoxy]pyridine-3-carboxamide is sourced from PubChem (CID 64574041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).