2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine

C14H29NO — CID 115889323

IUPAC2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine
SMILESCC(C)COCC(C)NC1CCCCC1C
InChIInChI=1S/C14H29NO/c1-11(2)9-16-10-13(4)15-14-8-6-5-7-12(14)3/h11-15H,5-10H2,1-4H3
InChIKeyVODFOYALFCXHEL-UHFFFAOYSA-N
MW227.39 g/mol
LogP3.22
Rot. Bonds6

About 2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine

2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine (PubChem CID 115889323) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is 2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine
PubChem CID115889323
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC Name2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine
SMILESCC(C)COCC(C)NC1CCCCC1C
InChIInChI=1S/C14H29NO/c1-11(2)9-16-10-13(4)15-14-8-6-5-7-12(14)3/h11-15H,5-10H2,1-4H3
InChIKeyVODFOYALFCXHEL-UHFFFAOYSA-N
XLogP3.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(2-methylpropoxy)propan-2-yl]cyclopentanamine
CID 115615668
cis-(1S,2R)-N-[(2S)-butan-2-yl]-2-methylcyclohexan-1-amine
CID 124709757
2-methyl-N-[2-[2-(2-methylpropoxy)ethoxy]ethyl]cyclohexan-1-amine
CID 106450291
N-(4-methoxy-4-methylpentan-2-yl)-2-methylcyclopentan-1-amine
CID 63277832
(4R)-4-[[(1S,2R)-2-methylcyclohexyl]amino]pentan-1-ol
CID 124710122
N-hex-5-en-2-yl-2-methylcyclohexan-1-amine
CID 104581310
N-(1-ethoxy-3-methylbutan-2-yl)-2-methylcyclopentan-1-amine
CID 103271639
N-(1-cyclopentylethyl)-2-methylcyclohexan-1-amine
CID 62631533
N-(1-methoxypropan-2-yl)-2,6-dimethylcyclohexan-1-amine
CID 13090556
(2R)-4-methyl-2-[[(1S,2S)-2-methylcyclohexyl]amino]pentan-1-ol
CID 124526620
N-(1-ethylsulfanylpropan-2-yl)-2-methylcyclopentan-1-amine
CID 115725602
2-[[(1S,2R)-2-methylcyclohexyl]amino]propane-1,3-diol
CID 96980097

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine?
The IUPAC name of 2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine (CID 115889323) is 2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine.
What is the SMILES notation for 2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine?
The canonical SMILES for 2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine is CC(C)COCC(C)NC1CCCCC1C.
What is the InChIKey of 2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine?
The InChIKey is VODFOYALFCXHEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-11(2)9-16-10-13(4)15-14-8-6-5-7-12(14)3/h11-15H,5-10H2,1-4H3.
What are the key properties of 2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine?
2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine has a molecular weight of 227.39 g/mol, XLogP of 3.22, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[1-(2-methylpropoxy)propan-2-yl]cyclohexan-1-amine is sourced from PubChem (CID 115889323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).