N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide

C15H23N3O2 — CID 120704184

IUPACN-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide
SMILESCNCC(=O)NCc1ccnc(OC2CCCCC2)c1
InChIInChI=1S/C15H23N3O2/c1-16-11-14(19)18-10-12-7-8-17-15(9-12)20-13-5-3-2-4-6-13/h7-9,13,16H,2-6,10-11H2,1H3,(H,18,19)
InChIKeyHOXQNXNVEXTZLX-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.63
Rot. Bonds6

About N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide

N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide (PubChem CID 120704184) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide
PubChem CID120704184
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide
SMILESCNCC(=O)NCc1ccnc(OC2CCCCC2)c1
InChIInChI=1S/C15H23N3O2/c1-16-11-14(19)18-10-12-7-8-17-15(9-12)20-13-5-3-2-4-6-13/h7-9,13,16H,2-6,10-11H2,1H3,(H,18,19)
InChIKeyHOXQNXNVEXTZLX-UHFFFAOYSA-N
XLogP1.63
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[[(2-cyclopentyloxy-4-pyridinyl)methylcarbamoylamino]methyl]-N-methylbenzamide
CID 38348110
ethyl N-[2-[(2-cyclopentyloxy-4-pyridinyl)methylamino]-2-oxoethyl]-N-methylcarbamate
CID 51082173
5-[(2-cyclohexyloxy-4-pyridinyl)methylcarbamoyl]pyrazine-2-carboxylic acid
CID 120690264
(2S)-N-[(2-cyclohexyloxy-4-pyridinyl)methyl]oxolane-2-carboxamide
CID 94801440
(2S)-2-acetamido-N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-3-methylbutanamide
CID 95301519
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-2-methoxybenzamide
CID 86981497
1-[(2-cyclobutyloxy-4-pyridinyl)methyl]-2,3-dimethylguanidine;hydroiodide
CID 86781351
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]pyrazine-2-carboxamide
CID 53499351
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-N'-methylpyrrolidine-1-carboximidamide;hydroiodide
CID 119114503
(3R)-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-3-methoxypiperidine-1-carboxamide
CID 95316935
N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-1-methylindole-3-carboxamide
CID 75403194
3-acetamido-N-[(2-cyclopentyloxy-4-pyridinyl)methyl]-3-(4-methylphenyl)propanamide
CID 86981473

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide?
The IUPAC name of N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide (CID 120704184) is N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide.
What is the SMILES notation for N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide?
The canonical SMILES for N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide is CNCC(=O)NCc1ccnc(OC2CCCCC2)c1.
What is the InChIKey of N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide?
The InChIKey is HOXQNXNVEXTZLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-16-11-14(19)18-10-12-7-8-17-15(9-12)20-13-5-3-2-4-6-13/h7-9,13,16H,2-6,10-11H2,1H3,(H,18,19).
What are the key properties of N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide?
N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide has a molecular weight of 277.37 g/mol, XLogP of 1.63, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclohexyloxy-4-pyridinyl)methyl]-2-(methylamino)acetamide is sourced from PubChem (CID 120704184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).