N-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide

C13H26N2O — CID 106829154

IUPACN-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide
SMILESCN(C(=O)C1(C)CCCCC1)C(C)(C)CN
InChIInChI=1S/C13H26N2O/c1-12(2,10-14)15(4)11(16)13(3)8-6-5-7-9-13/h5-10,14H2,1-4H3
InChIKeyLLXXOJNSPJNXMU-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.15
Rot. Bonds3

About N-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide

N-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide (PubChem CID 106829154) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide
PubChem CID106829154
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide
SMILESCN(C(=O)C1(C)CCCCC1)C(C)(C)CN
InChIInChI=1S/C13H26N2O/c1-12(2,10-14)15(4)11(16)13(3)8-6-5-7-9-13/h5-10,14H2,1-4H3
InChIKeyLLXXOJNSPJNXMU-UHFFFAOYSA-N
XLogP2.15
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromopropyl)-N,1-dimethylcyclohexane-1-carboxamide
CID 106828970
N-(2-amino-3-methoxypropyl)-N,1-dimethylcyclohexane-1-carboxamide
CID 106829127
N-(2-amino-2-hydroxyiminoethyl)-N,1-dimethylcyclohexane-1-carboxamide
CID 106828686
N-(2-amino-1-cyclopropylethyl)-N,1-dimethylcyclopentane-1-carboxamide
CID 116651586
N-(2-aminoethyl)-N-(2,2-difluoroethyl)-1-methylcyclopentane-1-carboxamide
CID 107493421
N,1-dimethyl-N-propan-2-ylcyclopentane-1-carboxamide
CID 128925463
2-[1-(aminomethyl)cyclohexyl]-N-(1-hydroxy-2-methylpropan-2-yl)-N-methylacetamide
CID 113475600
N-(2-hydroxy-3-methoxypropyl)-N,1-dimethylcyclohexane-1-carboxamide
CID 105056166
1-amino-N-[2-(dimethylamino)-2-methylpropyl]cyclohexane-1-carboxamide;dihydrochloride
CID 119830623
1-amino-2-(1-methylcyclohexyl)propan-2-ol
CID 139026363
N-[4-(aminomethyl)phenyl]-N-ethyl-1-methylcyclohexane-1-carboxamide
CID 106825964
N-(1-amino-2-methyl-1-sulfanylidenepropan-2-yl)-1-methylcyclohexane-1-carboxamide
CID 106827317

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide?
The IUPAC name of N-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide (CID 106829154) is N-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide.
What is the SMILES notation for N-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide?
The canonical SMILES for N-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide is CN(C(=O)C1(C)CCCCC1)C(C)(C)CN.
What is the InChIKey of N-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide?
The InChIKey is LLXXOJNSPJNXMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-12(2,10-14)15(4)11(16)13(3)8-6-5-7-9-13/h5-10,14H2,1-4H3.
What are the key properties of N-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide?
N-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide has a molecular weight of 226.36 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-methylpropan-2-yl)-N,1-dimethylcyclohexane-1-carboxamide is sourced from PubChem (CID 106829154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).