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

C16H23ClN2O — CID 63500418

IUPAC5-chloro-N-(cyclohexylmethyl)-2-(ethylamino)benzamide
SMILESCCNc1ccc(Cl)cc1C(=O)NCC1CCCCC1
InChIInChI=1S/C16H23ClN2O/c1-2-18-15-9-8-13(17)10-14(15)16(20)19-11-12-6-4-3-5-7-12/h8-10,12,18H,2-7,11H2,1H3,(H,19,20)
InChIKeyYOSODSAKVXJEJU-UHFFFAOYSA-N
MW294.83 g/mol
LogP4.08
Rot. Bonds5

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

5-chloro-N-(cyclohexylmethyl)-2-(ethylamino)benzamide (PubChem CID 63500418) has the molecular formula C16H23ClN2O and a molecular weight of 294.83 g/mol. Its IUPAC name is 5-chloro-N-(cyclohexylmethyl)-2-(ethylamino)benzamide.

Molecular Properties

Compound Name5-chloro-N-(cyclohexylmethyl)-2-(ethylamino)benzamide
PubChem CID63500418
Molecular FormulaC16H23ClN2O
Molecular Weight294.83 g/mol
Exact Mass294.15
IUPAC Name5-chloro-N-(cyclohexylmethyl)-2-(ethylamino)benzamide
SMILESCCNc1ccc(Cl)cc1C(=O)NCC1CCCCC1
InChIInChI=1S/C16H23ClN2O/c1-2-18-15-9-8-13(17)10-14(15)16(20)19-11-12-6-4-3-5-7-12/h8-10,12,18H,2-7,11H2,1H3,(H,19,20)
InChIKeyYOSODSAKVXJEJU-UHFFFAOYSA-N
XLogP4.08
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.83
LogP ≤ 54.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-(cyclopropylmethyl)-2-(ethylamino)benzamide
CID 62173260
5-chloro-2-(ethylamino)-N-[(2-methylcyclohexyl)methyl]benzamide
CID 63500607
5-chloro-2-(ethylamino)-N-(thiolan-3-ylmethyl)benzamide
CID 107298119
5-chloro-N-(cyclohexylmethyl)-2-fluorobenzamide
CID 60674706
5-chloro-N-(cyclohexylmethyl)-2-methoxybenzamide
CID 2666780
5-chloro-N-(cyclobutylmethyl)-2-(methanesulfonamido)benzamide
CID 49194436
5-chloro-N-(1-cyclopropylpropan-2-yl)-2-(ethylamino)benzamide
CID 63995007
N-(cyclopentylmethyl)-4-(ethylamino)pyridine-3-carboxamide
CID 81236600
5-chloro-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-(ethylamino)benzamide
CID 62978216
5-chloro-N-[2-[cyclopropyl(methyl)amino]propyl]-2-(ethylamino)benzamide
CID 103529934
N-(cyclohexylmethyl)-2-(ethylamino)-3-fluorobenzamide
CID 62661338
5-chloro-2-[[2-(cyclopropylmethylamino)acetyl]amino]-N-ethylbenzamide;hydrochloride
CID 119770124

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(cyclohexylmethyl)-2-(ethylamino)benzamide?
The IUPAC name of 5-chloro-N-(cyclohexylmethyl)-2-(ethylamino)benzamide (CID 63500418) is 5-chloro-N-(cyclohexylmethyl)-2-(ethylamino)benzamide.
What is the SMILES notation for 5-chloro-N-(cyclohexylmethyl)-2-(ethylamino)benzamide?
The canonical SMILES for 5-chloro-N-(cyclohexylmethyl)-2-(ethylamino)benzamide is CCNc1ccc(Cl)cc1C(=O)NCC1CCCCC1.
What is the InChIKey of 5-chloro-N-(cyclohexylmethyl)-2-(ethylamino)benzamide?
The InChIKey is YOSODSAKVXJEJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23ClN2O/c1-2-18-15-9-8-13(17)10-14(15)16(20)19-11-12-6-4-3-5-7-12/h8-10,12,18H,2-7,11H2,1H3,(H,19,20).
What are the key properties of 5-chloro-N-(cyclohexylmethyl)-2-(ethylamino)benzamide?
5-chloro-N-(cyclohexylmethyl)-2-(ethylamino)benzamide has a molecular weight of 294.83 g/mol, XLogP of 4.08, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(cyclohexylmethyl)-2-(ethylamino)benzamide is sourced from PubChem (CID 63500418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).