N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine

C13H25N — CID 115677489

IUPACN-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine
SMILESCC1CC(NC(C)C2CCCCC2)C1
InChIInChI=1S/C13H25N/c1-10-8-13(9-10)14-11(2)12-6-4-3-5-7-12/h10-14H,3-9H2,1-2H3
InChIKeyNGJZLHVRHDMCPS-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.34
Rot. Bonds3

About N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine

N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine (PubChem CID 115677489) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine.

Molecular Properties

Compound NameN-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine
PubChem CID115677489
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC NameN-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine
SMILESCC1CC(NC(C)C2CCCCC2)C1
InChIInChI=1S/C13H25N/c1-10-8-13(9-10)14-11(2)12-6-4-3-5-7-12/h10-14H,3-9H2,1-2H3
InChIKeyNGJZLHVRHDMCPS-UHFFFAOYSA-N
XLogP3.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1S)-1-cyclohexylethyl]-3-methylcyclopentan-1-amine
CID 81387418
N-(1-cyclohexylethyl)-3-methylcyclohexan-1-amine
CID 43775460
N-[(1S)-1-cycloheptylethyl]cycloheptanamine
CID 81389840
N-(1-cyclopropylethyl)cyclohexanamine
CID 43177177
N-(1-cyclohexylethyl)-4-propan-2-ylcyclohexan-1-amine
CID 63478862
N-[(1R)-1-cycloheptylethyl]-4-propan-2-ylcyclohexan-1-amine
CID 81393268
N-[(1R)-1-cyclopentylethyl]-3,4-dimethylcyclohexan-1-amine
CID 81395850
N-(1-cyclopentylethyl)-3-methoxycyclobutan-1-amine
CID 104584547
N-[(1R)-1-cyclohexylethyl]-5-methylthiolan-3-amine
CID 81384917
N-[(1R)-1-cyclohexylethyl]-2,4-dimethylcyclohexan-1-amine
CID 81385364
N-[(1S)-1-cyclohexylethyl]oxetan-3-amine
CID 81388066
3,5-dimethyl-N-propan-2-ylcyclohexan-1-amine
CID 21034318

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine?
The IUPAC name of N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine (CID 115677489) is N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine.
What is the SMILES notation for N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine?
The canonical SMILES for N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine is CC1CC(NC(C)C2CCCCC2)C1.
What is the InChIKey of N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine?
The InChIKey is NGJZLHVRHDMCPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-10-8-13(9-10)14-11(2)12-6-4-3-5-7-12/h10-14H,3-9H2,1-2H3.
What are the key properties of N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine?
N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine has a molecular weight of 195.35 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclohexylethyl)-3-methylcyclobutan-1-amine is sourced from PubChem (CID 115677489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).