2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide

C15H21ClN2O — CID 43653317

IUPAC2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide
SMILESCCNC1CCC(NC(=O)c2ccccc2Cl)CC1
InChIInChI=1S/C15H21ClN2O/c1-2-17-11-7-9-12(10-8-11)18-15(19)13-5-3-4-6-14(13)16/h3-6,11-12,17H,2,7-10H2,1H3,(H,18,19)
InChIKeyGTXBBKGOYMCXPF-UHFFFAOYSA-N
MW280.80 g/mol
LogP2.99
Rot. Bonds4

About 2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide

2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide (PubChem CID 43653317) has the molecular formula C15H21ClN2O and a molecular weight of 280.80 g/mol. Its IUPAC name is 2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide
PubChem CID43653317
Molecular FormulaC15H21ClN2O
Molecular Weight280.80 g/mol
Exact Mass280.13
IUPAC Name2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide
SMILESCCNC1CCC(NC(=O)c2ccccc2Cl)CC1
InChIInChI=1S/C15H21ClN2O/c1-2-17-11-7-9-12(10-8-11)18-15(19)13-5-3-4-6-14(13)16/h3-6,11-12,17H,2,7-10H2,1H3,(H,18,19)
InChIKeyGTXBBKGOYMCXPF-UHFFFAOYSA-N
XLogP2.99
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 ≤ 52.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-N-[4-(propylamino)cyclohexyl]benzamide
CID 43653408
2-chloro-N-cyclopentylbenzamide
CID 669043
N-[4-(ethylamino)cyclohexyl]-2-fluoro-3-methylbenzamide
CID 81481989
N-(1-butanoylpiperidin-4-yl)-2-chlorobenzamide
CID 110819269
trans-(1R,3R)-3-[(2-chlorobenzoyl)amino]cyclopentane-1-carboxylic acid
CID 97318284
N-cyclopropyl-2-methylbenzamide;hydrochloride
CID 162767207
2-chloro-N-[2-[(N-cyclopropyl-N'-methylcarbamimidoyl)amino]ethyl]benzamide
CID 110934653
N-[4-(ethylamino)cyclohexyl]-2-hydroxy-5-methylbenzamide
CID 43653300
methyl 4-[(2-chlorobenzoyl)amino]piperidine-1-carboxylate
CID 47392418
2-chloro-N-(3-formylcyclopentyl)benzamide
CID 174874670
2-chloro-N-cycloheptylbenzamide;pyrrolidine
CID 143233402
2-chloro-N-[1-(cyclopropanecarbonyl)piperidin-4-yl]benzamide
CID 110819420

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide?
The IUPAC name of 2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide (CID 43653317) is 2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide.
What is the SMILES notation for 2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide?
The canonical SMILES for 2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide is CCNC1CCC(NC(=O)c2ccccc2Cl)CC1.
What is the InChIKey of 2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide?
The InChIKey is GTXBBKGOYMCXPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O/c1-2-17-11-7-9-12(10-8-11)18-15(19)13-5-3-4-6-14(13)16/h3-6,11-12,17H,2,7-10H2,1H3,(H,18,19).
What are the key properties of 2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide?
2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide has a molecular weight of 280.80 g/mol, XLogP of 2.99, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[4-(ethylamino)cyclohexyl]benzamide is sourced from PubChem (CID 43653317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).