N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide

C15H21ClN2O — CID 119764374

IUPACN-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide
SMILESCNCC(=O)NC1(c2ccc(Cl)cc2)CCCCC1
InChIInChI=1S/C15H21ClN2O/c1-17-11-14(19)18-15(9-3-2-4-10-15)12-5-7-13(16)8-6-12/h5-8,17H,2-4,9-11H2,1H3,(H,18,19)
InChIKeyNZYWSEWTBJZKIL-UHFFFAOYSA-N
MW280.80 g/mol
LogP2.84
Rot. Bonds4

About N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide

N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide (PubChem CID 119764374) has the molecular formula C15H21ClN2O and a molecular weight of 280.80 g/mol. Its IUPAC name is N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide.

Molecular Properties

Compound NameN-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide
PubChem CID119764374
Molecular FormulaC15H21ClN2O
Molecular Weight280.80 g/mol
Exact Mass280.13
IUPAC NameN-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide
SMILESCNCC(=O)NC1(c2ccc(Cl)cc2)CCCCC1
InChIInChI=1S/C15H21ClN2O/c1-17-11-14(19)18-15(9-3-2-4-10-15)12-5-7-13(16)8-6-12/h5-8,17H,2-4,9-11H2,1H3,(H,18,19)
InChIKeyNZYWSEWTBJZKIL-UHFFFAOYSA-N
XLogP2.84
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.80
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(4-fluorophenyl)cyclopropyl]-2-(methylamino)acetamide
CID 110460355
4-amino-N-[1-(4-chlorophenyl)cyclopentyl]butanamide
CID 119313669
N-[1-(4-chlorophenyl)cyclopropyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111464638
N-[1-(4-chlorophenyl)cyclopropyl]butanamide
CID 113091058
N-[1-(4-chlorophenyl)cyclopentyl]-2-pyrrolidin-2-ylacetamide
CID 119766573
N-[1-(3-chlorophenyl)cyclopentyl]-2-(methylcarbamoylamino)acetamide
CID 75393371
(2S)-2-(carbamoylamino)-N-[1-(4-chlorophenyl)cyclohexyl]propanamide
CID 95383338
3-(2-aminophenyl)-N-[1-(4-chlorophenyl)cyclopentyl]propanamide;hydrochloride
CID 120610238
3-amino-N-[1-(4-methoxyphenyl)cyclohexyl]propanamide
CID 110478988
2-(methylamino)-N-[1-[3-(trifluoromethyl)phenyl]cyclobutyl]acetamide;hydrochloride
CID 119806409
N-[1-(4-chlorophenyl)cyclobutyl]-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide
CID 74248713
N-(1-phenylcyclohexyl)butanamide
CID 110478581

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide?
The IUPAC name of N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide (CID 119764374) is N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide.
What is the SMILES notation for N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide?
The canonical SMILES for N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide is CNCC(=O)NC1(c2ccc(Cl)cc2)CCCCC1.
What is the InChIKey of N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide?
The InChIKey is NZYWSEWTBJZKIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O/c1-17-11-14(19)18-15(9-3-2-4-10-15)12-5-7-13(16)8-6-12/h5-8,17H,2-4,9-11H2,1H3,(H,18,19).
What are the key properties of N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide?
N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide has a molecular weight of 280.80 g/mol, XLogP of 2.84, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-chlorophenyl)cyclohexyl]-2-(methylamino)acetamide is sourced from PubChem (CID 119764374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).