5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide

C14H28N2O — CID 63961904

IUPAC5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide
SMILESCCC(C)(C)N(C)C(=O)C1CC(N)CCC1C
InChIInChI=1S/C14H28N2O/c1-6-14(3,4)16(5)13(17)12-9-11(15)8-7-10(12)2/h10-12H,6-9,15H2,1-5H3
InChIKeyKXJXOPVYOSEQIM-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.40
Rot. Bonds3

About 5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide

5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide (PubChem CID 63961904) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide
PubChem CID63961904
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide
SMILESCCC(C)(C)N(C)C(=O)C1CC(N)CCC1C
InChIInChI=1S/C14H28N2O/c1-6-14(3,4)16(5)13(17)12-9-11(15)8-7-10(12)2/h10-12H,6-9,15H2,1-5H3
InChIKeyKXJXOPVYOSEQIM-UHFFFAOYSA-N
XLogP2.40
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide?
The IUPAC name of 5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide (CID 63961904) is 5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide.
What is the SMILES notation for 5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide?
The canonical SMILES for 5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide is CCC(C)(C)N(C)C(=O)C1CC(N)CCC1C.
What is the InChIKey of 5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide?
The InChIKey is KXJXOPVYOSEQIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-6-14(3,4)16(5)13(17)12-9-11(15)8-7-10(12)2/h10-12H,6-9,15H2,1-5H3.
What are the key properties of 5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide?
5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide has a molecular weight of 240.39 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N,2-dimethyl-N-(2-methylbutan-2-yl)cyclohexane-1-carboxamide is sourced from PubChem (CID 63961904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).