N-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide

C16H24N2O2 — CID 43787667

IUPACN-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide
SMILESCCNC(=O)c1ccc(NC2CCCCC2OC)cc1
InChIInChI=1S/C16H24N2O2/c1-3-17-16(19)12-8-10-13(11-9-12)18-14-6-4-5-7-15(14)20-2/h8-11,14-15,18H,3-7H2,1-2H3,(H,17,19)
InChIKeyKHMQGWYJNCNJGR-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.81
Rot. Bonds5

About N-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide

N-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide (PubChem CID 43787667) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide.

Molecular Properties

Compound NameN-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide
PubChem CID43787667
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC NameN-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide
SMILESCCNC(=O)c1ccc(NC2CCCCC2OC)cc1
InChIInChI=1S/C16H24N2O2/c1-3-17-16(19)12-8-10-13(11-9-12)18-14-6-4-5-7-15(14)20-2/h8-11,14-15,18H,3-7H2,1-2H3,(H,17,19)
InChIKeyKHMQGWYJNCNJGR-UHFFFAOYSA-N
XLogP2.81
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide?
The IUPAC name of N-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide (CID 43787667) is N-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide.
What is the SMILES notation for N-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide?
The canonical SMILES for N-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide is CCNC(=O)c1ccc(NC2CCCCC2OC)cc1.
What is the InChIKey of N-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide?
The InChIKey is KHMQGWYJNCNJGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-3-17-16(19)12-8-10-13(11-9-12)18-14-6-4-5-7-15(14)20-2/h8-11,14-15,18H,3-7H2,1-2H3,(H,17,19).
What are the key properties of N-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide?
N-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide has a molecular weight of 276.38 g/mol, XLogP of 2.81, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[(2-methoxycyclohexyl)amino]benzamide is sourced from PubChem (CID 43787667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).