2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide

C17H32N2O2 — CID 83035895

IUPAC2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide
SMILESCCC1(CC)CC(NC(=O)C2CC(C)CCC2N)CCO1
InChIInChI=1S/C17H32N2O2/c1-4-17(5-2)11-13(8-9-21-17)19-16(20)14-10-12(3)6-7-15(14)18/h12-15H,4-11,18H2,1-3H3,(H,19,20)
InChIKeyBACGEMFFZCQOBW-UHFFFAOYSA-N
MW296.45 g/mol
LogP2.60
Rot. Bonds4

About 2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide

2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide (PubChem CID 83035895) has the molecular formula C17H32N2O2 and a molecular weight of 296.45 g/mol. Its IUPAC name is 2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide
PubChem CID83035895
Molecular FormulaC17H32N2O2
Molecular Weight296.45 g/mol
Exact Mass296.25
IUPAC Name2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide
SMILESCCC1(CC)CC(NC(=O)C2CC(C)CCC2N)CCO1
InChIInChI=1S/C17H32N2O2/c1-4-17(5-2)11-13(8-9-21-17)19-16(20)14-10-12(3)6-7-15(14)18/h12-15H,4-11,18H2,1-3H3,(H,19,20)
InChIKeyBACGEMFFZCQOBW-UHFFFAOYSA-N
XLogP2.60
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.45
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,2-diethyloxan-4-yl)-4-methylpiperidine-2-carboxamide
CID 114424424
4-amino-N-(2,2-diethyloxan-4-yl)cyclopent-2-ene-1-carboxamide
CID 83029363
N-(2,2-diethyloxan-4-yl)-3-methylpyrrolidine-2-carboxamide
CID 102779942
1-(2,2-diethyloxan-4-yl)-3-propylurea
CID 115865557
(2S)-2-amino-N-(2,2-diethyloxan-4-yl)-3-methylpentanamide
CID 83029138
2-amino-N-(3-ethylcyclohexyl)-5-methylcyclohexane-1-carboxamide
CID 65455115
(2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide
CID 104901402
N-(2,2-diethyloxan-4-yl)prop-2-enamide
CID 83032720
2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide
CID 112555896
1-amino-N-(2,2-diethyloxan-4-yl)cyclobutane-1-carboxamide
CID 83028998
2-cyano-N-(2,2-diethyloxan-4-yl)-2-methylbutanamide
CID 83029367
N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide
CID 114429439

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide?
The IUPAC name of 2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide (CID 83035895) is 2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide?
The canonical SMILES for 2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide is CCC1(CC)CC(NC(=O)C2CC(C)CCC2N)CCO1.
What is the InChIKey of 2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide?
The InChIKey is BACGEMFFZCQOBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O2/c1-4-17(5-2)11-13(8-9-21-17)19-16(20)14-10-12(3)6-7-15(14)18/h12-15H,4-11,18H2,1-3H3,(H,19,20).
What are the key properties of 2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide?
2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide has a molecular weight of 296.45 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide is sourced from PubChem (CID 83035895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).