N-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide

C17H26N2O — CID 43653349

IUPACN-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide
SMILESCCNC1CCC(NC(=O)c2cc(C)cc(C)c2)CC1
InChIInChI=1S/C17H26N2O/c1-4-18-15-5-7-16(8-6-15)19-17(20)14-10-12(2)9-13(3)11-14/h9-11,15-16,18H,4-8H2,1-3H3,(H,19,20)
InChIKeyDMTQQOKJRRKSSI-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.95
Rot. Bonds4

About N-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide

N-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide (PubChem CID 43653349) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is N-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide.

Molecular Properties

Compound NameN-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide
PubChem CID43653349
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC NameN-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide
SMILESCCNC1CCC(NC(=O)c2cc(C)cc(C)c2)CC1
InChIInChI=1S/C17H26N2O/c1-4-18-15-5-7-16(8-6-15)19-17(20)14-10-12(2)9-13(3)11-14/h9-11,15-16,18H,4-8H2,1-3H3,(H,19,20)
InChIKeyDMTQQOKJRRKSSI-UHFFFAOYSA-N
XLogP2.95
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-dimethyl-N-(4-methylcyclohexyl)benzamide
CID 26877405
3,5-dimethyl-N-(4-oxocyclohexyl)benzamide
CID 43652880
1-N-cyclopropyl-3-N,3-N-diethyl-5-methylbenzene-1,3-dicarboxamide
CID 91483552
N-[4-(ethylamino)cyclohexyl]-N,3,5-trimethylbenzamide
CID 79119344
3-bromo-N-(4-ethylcyclohexyl)-5-methylbenzamide
CID 113460730
N-[4-(ethylamino)cyclohexyl]-3-fluorobenzamide
CID 43653350
N-[4-(ethylamino)cyclohexyl]-2-hydroxy-5-methylbenzamide
CID 43653300
N-(4-aminocyclohexyl)-3-bromo-5-methylbenzamide
CID 104850911
3-amino-N-cyclohexyl-5-methylbenzamide
CID 113396098
N-[4-[[2-(dimethylamino)-3-methylbutanoyl]amino]cyclohexyl]-3,5-dimethylbenzamide
CID 138007304
N-[4-(ethylamino)cyclohexyl]-2,5-dimethylfuran-3-carboxamide
CID 43653345
N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide
CID 16567528

Frequently Asked Questions

What is the IUPAC name of N-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide?
The IUPAC name of N-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide (CID 43653349) is N-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide.
What is the SMILES notation for N-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide?
The canonical SMILES for N-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide is CCNC1CCC(NC(=O)c2cc(C)cc(C)c2)CC1.
What is the InChIKey of N-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide?
The InChIKey is DMTQQOKJRRKSSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-4-18-15-5-7-16(8-6-15)19-17(20)14-10-12(2)9-13(3)11-14/h9-11,15-16,18H,4-8H2,1-3H3,(H,19,20).
What are the key properties of N-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide?
N-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide has a molecular weight of 274.41 g/mol, XLogP of 2.95, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(ethylamino)cyclohexyl]-3,5-dimethylbenzamide is sourced from PubChem (CID 43653349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).