2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide

C15H23N3O2 — CID 64677041

IUPAC2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide
SMILESCOc1cc(CNC(=O)CC2(N)CCCCC2)ccn1
InChIInChI=1S/C15H23N3O2/c1-20-14-9-12(5-8-17-14)11-18-13(19)10-15(16)6-3-2-4-7-15/h5,8-9H,2-4,6-7,10-11,16H2,1H3,(H,18,19)
InChIKeyFSNQZJAFHYHBQW-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.76
Rot. Bonds5

About 2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide

2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide (PubChem CID 64677041) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide.

Molecular Properties

Compound Name2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide
PubChem CID64677041
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide
SMILESCOc1cc(CNC(=O)CC2(N)CCCCC2)ccn1
InChIInChI=1S/C15H23N3O2/c1-20-14-9-12(5-8-17-14)11-18-13(19)10-15(16)6-3-2-4-7-15/h5,8-9H,2-4,6-7,10-11,16H2,1H3,(H,18,19)
InChIKeyFSNQZJAFHYHBQW-UHFFFAOYSA-N
XLogP1.76
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Ro 24-0238
CID 6439060
2-(4-methoxyphenyl)-N-(pyridin-3-yl)acetamide
CID 799060
Nalpha-[trans-4-(Aminomethyl)cyclohexane-1-Carbonyl]-N-Octyl-O-[(Pyridin-4-Yl)methyl]-L-Tyrosinamide
CID 10697355
ROCK inhibitor-2
CID 51003130
N-(4-methoxybenzyl)-N'-(pyridin-3-ylmethyl)ethanediamide
CID 3113974
N-[(4-methoxyphenyl)methyl]pyridine-4-carboxamide
CID 2303641
2(1H)-Pyridinone, 5-ethyl-3-(((2-methoxy-3-pyridinyl)methyl)amino)-6-methyl-
CID 454346
N-[(1R)-1-(3-methoxyphenyl)ethyl]-4-pyridin-4-ylcyclohexane-1-carboxamide
CID 168280932
N-[3-(3-Methoxy-benzoylamino)-propyl]-nicotinamide
CID 2989253
2-ethoxy-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide
CID 4794993
2-(2-bicyclo[2.2.1]heptanyl)-N-(6-methoxypyridin-3-yl)acetamide
CID 4878967
N-(4-methoxybenzyl)-N'-(pyridin-3-yl)butanediamide
CID 5237831

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide?
The IUPAC name of 2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide (CID 64677041) is 2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide.
What is the SMILES notation for 2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide?
The canonical SMILES for 2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide is COc1cc(CNC(=O)CC2(N)CCCCC2)ccn1.
What is the InChIKey of 2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide?
The InChIKey is FSNQZJAFHYHBQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-20-14-9-12(5-8-17-14)11-18-13(19)10-15(16)6-3-2-4-7-15/h5,8-9H,2-4,6-7,10-11,16H2,1H3,(H,18,19).
What are the key properties of 2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide?
2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide has a molecular weight of 277.37 g/mol, XLogP of 1.76, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclohexyl)-N-[(2-methoxy-4-pyridinyl)methyl]acetamide is sourced from PubChem (CID 64677041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).