5-amino-2-chloro-N-(cyclohexylmethyl)benzamide

C14H19ClN2O — CID 43371364

IUPAC5-amino-2-chloro-N-(cyclohexylmethyl)benzamide
SMILESNc1ccc(Cl)c(C(=O)NCC2CCCCC2)c1
InChIInChI=1S/C14H19ClN2O/c15-13-7-6-11(16)8-12(13)14(18)17-9-10-4-2-1-3-5-10/h6-8,10H,1-5,9,16H2,(H,17,18)
InChIKeyAANMPRTVURBKOL-UHFFFAOYSA-N
MW266.77 g/mol
LogP3.23
Rot. Bonds3

About 5-amino-2-chloro-N-(cyclohexylmethyl)benzamide

5-amino-2-chloro-N-(cyclohexylmethyl)benzamide (PubChem CID 43371364) has the molecular formula C14H19ClN2O and a molecular weight of 266.77 g/mol. Its IUPAC name is 5-amino-2-chloro-N-(cyclohexylmethyl)benzamide.

Molecular Properties

Compound Name5-amino-2-chloro-N-(cyclohexylmethyl)benzamide
PubChem CID43371364
Molecular FormulaC14H19ClN2O
Molecular Weight266.77 g/mol
Exact Mass266.12
IUPAC Name5-amino-2-chloro-N-(cyclohexylmethyl)benzamide
SMILESNc1ccc(Cl)c(C(=O)NCC2CCCCC2)c1
InChIInChI=1S/C14H19ClN2O/c15-13-7-6-11(16)8-12(13)14(18)17-9-10-4-2-1-3-5-10/h6-8,10H,1-5,9,16H2,(H,17,18)
InChIKeyAANMPRTVURBKOL-UHFFFAOYSA-N
XLogP3.23
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 ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-amino-2-chloro-N-[(4-hydroxycyclohexyl)methyl]benzamide
CID 106119078
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4-chloro-3-(cyclohexylmethylcarbamoyl)benzenesulfonyl chloride
CID 65371129
4-amino-1-N,2-N-bis(cyclopropylmethyl)benzene-1,2-dicarboxamide
CID 165390196
5-amino-N-(cyclobutylmethyl)-2-methylbenzamide;hydrochloride
CID 120622474
5-bromo-2-chloro-N-(cyclobutylmethyl)benzamide
CID 38655696
5-amino-2-chloro-N-(cyclopentylmethyl)pyridine-3-carboxamide
CID 114045919
2-amino-3-chloro-N-(cyclopentylmethyl)benzamide
CID 115540050
1-(4-amino-2-chlorophenyl)-3-(cyclopentylmethyl)urea
CID 108902549
4-amino-2-chloro-N-(oxan-3-ylmethyl)benzamide
CID 61140038
2,3-dichloro-N-(cyclohexylmethyl)benzamide
CID 23019884
5-chloro-N-(cyclohexylmethyl)-2-fluorobenzamide
CID 60674706

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-chloro-N-(cyclohexylmethyl)benzamide?
The IUPAC name of 5-amino-2-chloro-N-(cyclohexylmethyl)benzamide (CID 43371364) is 5-amino-2-chloro-N-(cyclohexylmethyl)benzamide.
What is the SMILES notation for 5-amino-2-chloro-N-(cyclohexylmethyl)benzamide?
The canonical SMILES for 5-amino-2-chloro-N-(cyclohexylmethyl)benzamide is Nc1ccc(Cl)c(C(=O)NCC2CCCCC2)c1.
What is the InChIKey of 5-amino-2-chloro-N-(cyclohexylmethyl)benzamide?
The InChIKey is AANMPRTVURBKOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O/c15-13-7-6-11(16)8-12(13)14(18)17-9-10-4-2-1-3-5-10/h6-8,10H,1-5,9,16H2,(H,17,18).
What are the key properties of 5-amino-2-chloro-N-(cyclohexylmethyl)benzamide?
5-amino-2-chloro-N-(cyclohexylmethyl)benzamide has a molecular weight of 266.77 g/mol, XLogP of 3.23, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-chloro-N-(cyclohexylmethyl)benzamide is sourced from PubChem (CID 43371364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).