N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane

C12H27N — CID 159032634

IUPACN-(cyclohexylmethyl)-2-methylpropan-2-amine;methane
SMILESC.CC(C)(C)NCC1CCCCC1
InChIInChI=1S/C11H23N.CH4/c1-11(2,3)12-9-10-7-5-4-6-8-10;/h10,12H,4-9H2,1-3H3;1H4
InChIKeyJVBJTMGMKRRYFR-UHFFFAOYSA-N
MW185.36 g/mol
LogP3.59
Rot. Bonds2

About N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane

N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane (PubChem CID 159032634) has the molecular formula C12H27N and a molecular weight of 185.36 g/mol. Its IUPAC name is N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane.

Molecular Properties

Compound NameN-(cyclohexylmethyl)-2-methylpropan-2-amine;methane
PubChem CID159032634
Molecular FormulaC12H27N
Molecular Weight185.36 g/mol
Exact Mass185.21
IUPAC NameN-(cyclohexylmethyl)-2-methylpropan-2-amine;methane
SMILESC.CC(C)(C)NCC1CCCCC1
InChIInChI=1S/C11H23N.CH4/c1-11(2,3)12-9-10-7-5-4-6-8-10;/h10,12H,4-9H2,1-3H3;1H4
InChIKeyJVBJTMGMKRRYFR-UHFFFAOYSA-N
XLogP3.59
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.36
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

tert-butylsulfanylmethylcyclohexane;N-(cyclohexylmethyl)-2-methylpropan-2-amine;N-(cyclopropylmethyl)-2-methylpropan-2-amine
CID 161245783
N-[(1-cyclohexylpiperidin-4-yl)methyl]-2-methylpropan-2-amine
CID 63849814
N-(cyclopentylmethyl)-3-methylpentan-3-amine
CID 103746706
3-(cycloheptylmethylamino)-2,3-dimethylbutan-2-ol
CID 104694704
N-[[4-(aminomethyl)cyclohexyl]methyl]-2-methylpropan-2-amine
CID 59867972
N-(cyclopent-3-en-1-ylmethyl)-2-methylpropan-2-amine
CID 65353678
N-[[5-(cyclopentylmethoxymethyl)oxolan-2-yl]methyl]-2-methylpropan-2-amine
CID 66324414
2-methyl-N-(4-tetracyclo[12.4.0.02,6.07,12]octadecanylmethyl)propan-2-amine
CID 59100363
N-(cyclobutylmethyl)-2-methylbutan-2-amine
CID 65460080
N-[[5-(cycloheptyloxymethyl)oxolan-2-yl]methyl]-2-methylpropan-2-amine
CID 62460585
N-[(2-cyclopentylcycloheptyl)methyl]-2-methylpropan-2-amine
CID 81025228
N-[(3-methoxycyclobutyl)methyl]-2-methylpropan-2-amine
CID 106824564

Frequently Asked Questions

What is the IUPAC name of N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane?
The IUPAC name of N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane (CID 159032634) is N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane.
What is the SMILES notation for N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane?
The canonical SMILES for N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane is C.CC(C)(C)NCC1CCCCC1.
What is the InChIKey of N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane?
The InChIKey is JVBJTMGMKRRYFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N.CH4/c1-11(2,3)12-9-10-7-5-4-6-8-10;/h10,12H,4-9H2,1-3H3;1H4.
What are the key properties of N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane?
N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane has a molecular weight of 185.36 g/mol, XLogP of 3.59, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexylmethyl)-2-methylpropan-2-amine;methane is sourced from PubChem (CID 159032634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).