N-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide

C14H19ClN2O — CID 62504081

IUPACN-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide
SMILESNC1CCC(NC(=O)Cc2cccc(Cl)c2)CC1
InChIInChI=1S/C14H19ClN2O/c15-11-3-1-2-10(8-11)9-14(18)17-13-6-4-12(16)5-7-13/h1-3,8,12-13H,4-7,9,16H2,(H,17,18)
InChIKeyPAGPNCIXVKXQPC-UHFFFAOYSA-N
MW266.77 g/mol
LogP2.27
Rot. Bonds3

About N-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide

N-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide (PubChem CID 62504081) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide
PubChem CID62504081
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC NameN-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide
SMILESNC1CCC(NC(=O)Cc2cccc(Cl)c2)CC1
InChIInChI=1S/C14H19ClN2O/c15-11-3-1-2-10(8-11)9-14(18)17-13-6-4-12(16)5-7-13/h1-3,8,12-13H,4-7,9,16H2,(H,17,18)
InChIKeyPAGPNCIXVKXQPC-UHFFFAOYSA-N
XLogP2.27
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.77
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-bromocyclohexyl)-2-(3-chlorophenyl)acetamide
CID 113274232
N-(4-aminocyclohexyl)-2-(3-methylphenyl)acetamide
CID 62387693
N-(4-aminocyclohexyl)-2-(3-iodophenyl)acetamide
CID 119475463
N-(4-aminocyclohexyl)-2-(3-fluorophenyl)acetamide;hydrochloride
CID 119260253
N-(8-azabicyclo[3.2.1]octan-3-yl)-2-(3-chlorophenyl)acetamide
CID 55084121
N-(4-aminocyclohexyl)-2-(2,4-dichlorophenyl)acetamide;hydrochloride
CID 119474323
N-(4-aminocyclohexyl)-3-chlorobenzamide
CID 62313478
N-cyclopropyl-2-(3,5-dichlorophenyl)acetamide
CID 110486749
3-(3-chlorophenyl)-N-[2-(cyclopropylamino)-2-oxoethyl]propanamide
CID 47142765
2-(3-chlorophenyl)-N-[1-(cyanomethyl)piperidin-4-yl]acetamide
CID 63625205
4-[[2-(3-chlorophenyl)acetyl]amino]-N-propan-2-ylpiperidine-1-carboxamide
CID 110822388
1-(3-chlorophenyl)-3-cyclopentylpropan-2-one
CID 62504262

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide?
The IUPAC name of N-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide (CID 62504081) is N-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide?
The canonical SMILES for N-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide is NC1CCC(NC(=O)Cc2cccc(Cl)c2)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide?
The InChIKey is PAGPNCIXVKXQPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c15-11-3-1-2-10(8-11)9-14(18)17-13-6-4-12(16)5-7-13/h1-3,8,12-13H,4-7,9,16H2,(H,17,18).
What are the key properties of N-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide?
N-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide has a molecular weight of 266.77 g/mol, XLogP of 2.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-2-(3-chlorophenyl)acetamide is sourced from PubChem (CID 62504081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).