cis-(1R,2S)-2-methylcyclohexan-1-amine

C7H15N — CID 638182

IUPACcis-(1R,2S)-2-methylcyclohexan-1-amine
SMILESC[C@H]1CCCC[C@H]1N
InChIInChI=1S/C7H15N/c1-6-4-2-3-5-7(6)8/h6-7H,2-5,8H2,1H3/t6-,7+/m0/s1
InChIKeyFEUISMYEFPANSS-NKWVEPMBSA-N
MW113.20 g/mol
LogP1.52
Rot. Bonds

About cis-(1R,2S)-2-methylcyclohexan-1-amine

cis-(1R,2S)-2-methylcyclohexan-1-amine (PubChem CID 638182) has the molecular formula C7H15N and a molecular weight of 113.20 g/mol. Its IUPAC name is cis-(1R,2S)-2-methylcyclohexan-1-amine.

Molecular Properties

Compound Namecis-(1R,2S)-2-methylcyclohexan-1-amine
PubChem CID638182
Molecular FormulaC7H15N
Molecular Weight113.20 g/mol
Exact Mass113.12
IUPAC Namecis-(1R,2S)-2-methylcyclohexan-1-amine
SMILESC[C@H]1CCCC[C@H]1N
InChIInChI=1S/C7H15N/c1-6-4-2-3-5-7(6)8/h6-7H,2-5,8H2,1H3/t6-,7+/m0/s1
InChIKeyFEUISMYEFPANSS-NKWVEPMBSA-N
XLogP1.52
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.20
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethene;2-methylcyclohexan-1-amine
CID 142086710
(1S)-2-methylcyclopentan-1-amine
CID 154545726
trans-(1S,2S)-2-methylcyclopentan-1-amine;hydrochloride
CID 13184369
cis-(1R,2S)-1,2-dimethylcyclohexane;methanamine
CID 142167756
2-ethyl-3-methylcycloheptan-1-amine
CID 139376160
butane-1,2,3,4-tetracarboxylic acid;2-methylcyclohexan-1-amine
CID 172742405
1,2-dimethylcycloicosane
CID 123296856
1,2-dimethylcyclononadecane
CID 123549851
trans-(1S,2S)-cycloundecane-1,2-diamine
CID 139815756
1,2-dimethylcyclohexane;vanadium
CID 142004480
2,7,7-trimethylcyclooctan-1-amine
CID 167202937
acetylene;3-methylaniline;2-methylcyclohexan-1-amine
CID 143436771

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2S)-2-methylcyclohexan-1-amine?
The IUPAC name of cis-(1R,2S)-2-methylcyclohexan-1-amine (CID 638182) is cis-(1R,2S)-2-methylcyclohexan-1-amine.
What is the SMILES notation for cis-(1R,2S)-2-methylcyclohexan-1-amine?
The canonical SMILES for cis-(1R,2S)-2-methylcyclohexan-1-amine is C[C@H]1CCCC[C@H]1N.
What is the InChIKey of cis-(1R,2S)-2-methylcyclohexan-1-amine?
The InChIKey is FEUISMYEFPANSS-NKWVEPMBSA-N. The full InChI is InChI=1S/C7H15N/c1-6-4-2-3-5-7(6)8/h6-7H,2-5,8H2,1H3/t6-,7+/m0/s1.
What are the key properties of cis-(1R,2S)-2-methylcyclohexan-1-amine?
cis-(1R,2S)-2-methylcyclohexan-1-amine has a molecular weight of 113.20 g/mol, XLogP of 1.52, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-methylcyclohexan-1-amine is sourced from PubChem (CID 638182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).