cycloheptyl(cyclohexyl)methanamine

C14H27N — CID 65399873

IUPACcycloheptyl(cyclohexyl)methanamine
SMILESNC(C1CCCCCC1)C1CCCCC1
InChIInChI=1S/C14H27N/c15-14(13-10-6-3-7-11-13)12-8-4-1-2-5-9-12/h12-14H,1-11,15H2
InChIKeyJIQZYXOZQIYLAR-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.86
Rot. Bonds2

About cycloheptyl(cyclohexyl)methanamine

cycloheptyl(cyclohexyl)methanamine (PubChem CID 65399873) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is cycloheptyl(cyclohexyl)methanamine.

Molecular Properties

Compound Namecycloheptyl(cyclohexyl)methanamine
PubChem CID65399873
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Namecycloheptyl(cyclohexyl)methanamine
SMILESNC(C1CCCCCC1)C1CCCCC1
InChIInChI=1S/C14H27N/c15-14(13-10-6-3-7-11-13)12-8-4-1-2-5-9-12/h12-14H,1-11,15H2
InChIKeyJIQZYXOZQIYLAR-UHFFFAOYSA-N
XLogP3.86
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-bicyclo[3.1.0]hexanyl(cyclohexyl)methanamine
CID 114981359
4-[amino(cyclopentyl)methyl]cyclohexan-1-ol
CID 116941893
6-bicyclo[3.1.0]hexanyl(cycloheptyl)methanamine
CID 105027674
cyclohexyl(silyl)methanamine
CID 174790563
cyclohexyl-[3-(trifluoromethyl)cyclohexyl]methanamine
CID 105079907
cycloheptyl(thiolan-2-yl)methanamine
CID 82932614
N'-[amino(cyclohexyl)methyl]-1-cyclohexylmethanediamine
CID 118145189
cyclopentyl-(3,3-difluorocyclopentyl)methanamine
CID 130484946
1-amino-1-cycloheptylpropan-2-one
CID 54549167
4-[amino(cyclobutyl)methyl]cyclohexan-1-one
CID 116942015
(1S)-1-amino-1-cyclohexylpropan-2-one
CID 59946338
di(cyclohexadecyl)methylcyclohexadecane
CID 175406938

Frequently Asked Questions

What is the IUPAC name of cycloheptyl(cyclohexyl)methanamine?
The IUPAC name of cycloheptyl(cyclohexyl)methanamine (CID 65399873) is cycloheptyl(cyclohexyl)methanamine.
What is the SMILES notation for cycloheptyl(cyclohexyl)methanamine?
The canonical SMILES for cycloheptyl(cyclohexyl)methanamine is NC(C1CCCCCC1)C1CCCCC1.
What is the InChIKey of cycloheptyl(cyclohexyl)methanamine?
The InChIKey is JIQZYXOZQIYLAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c15-14(13-10-6-3-7-11-13)12-8-4-1-2-5-9-12/h12-14H,1-11,15H2.
What are the key properties of cycloheptyl(cyclohexyl)methanamine?
cycloheptyl(cyclohexyl)methanamine has a molecular weight of 209.38 g/mol, XLogP of 3.86, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cycloheptyl(cyclohexyl)methanamine is sourced from PubChem (CID 65399873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).