4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide

C17H26N2O — CID 62179470

IUPAC4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide
SMILESCCNc1ccc(C(=O)N(C)C2CCCC(C)C2)cc1
InChIInChI=1S/C17H26N2O/c1-4-18-15-10-8-14(9-11-15)17(20)19(3)16-7-5-6-13(2)12-16/h8-11,13,16,18H,4-7,12H2,1-3H3
InChIKeyJHCPZBOGNVPULR-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.77
Rot. Bonds4

About 4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide

4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide (PubChem CID 62179470) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide.

Molecular Properties

Compound Name4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide
PubChem CID62179470
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide
SMILESCCNc1ccc(C(=O)N(C)C2CCCC(C)C2)cc1
InChIInChI=1S/C17H26N2O/c1-4-18-15-10-8-14(9-11-15)17(20)19(3)16-7-5-6-13(2)12-16/h8-11,13,16,18H,4-7,12H2,1-3H3
InChIKeyJHCPZBOGNVPULR-UHFFFAOYSA-N
XLogP3.77
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide?
The IUPAC name of 4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide (CID 62179470) is 4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide.
What is the SMILES notation for 4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide?
The canonical SMILES for 4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide is CCNc1ccc(C(=O)N(C)C2CCCC(C)C2)cc1.
What is the InChIKey of 4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide?
The InChIKey is JHCPZBOGNVPULR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-4-18-15-10-8-14(9-11-15)17(20)19(3)16-7-5-6-13(2)12-16/h8-11,13,16,18H,4-7,12H2,1-3H3.
What are the key properties of 4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide?
4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide has a molecular weight of 274.41 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N-methyl-N-(3-methylcyclohexyl)benzamide is sourced from PubChem (CID 62179470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).