(2S)-2-(methoxymethyl)cyclohexan-1-amine

C8H17NO — CID 89098977

IUPAC(2S)-2-(methoxymethyl)cyclohexan-1-amine
SMILESCOC[C@H]1CCCCC1N
InChIInChI=1S/C8H17NO/c1-10-6-7-4-2-3-5-8(7)9/h7-8H,2-6,9H2,1H3/t7-,8?/m1/s1
InChIKeyDOALQHGDJWRMDD-GVHYBUMESA-N
MW143.23 g/mol
LogP1.15
Rot. Bonds2

About (2S)-2-(methoxymethyl)cyclohexan-1-amine

(2S)-2-(methoxymethyl)cyclohexan-1-amine (PubChem CID 89098977) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (2S)-2-(methoxymethyl)cyclohexan-1-amine.

Molecular Properties

Compound Name(2S)-2-(methoxymethyl)cyclohexan-1-amine
PubChem CID89098977
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(2S)-2-(methoxymethyl)cyclohexan-1-amine
SMILESCOC[C@H]1CCCCC1N
InChIInChI=1S/C8H17NO/c1-10-6-7-4-2-3-5-8(7)9/h7-8H,2-6,9H2,1H3/t7-,8?/m1/s1
InChIKeyDOALQHGDJWRMDD-GVHYBUMESA-N
XLogP1.15
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-2-(methoxymethyl)cyclohexan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(methoxymethyl)cyclohexan-1-amine?
The IUPAC name of (2S)-2-(methoxymethyl)cyclohexan-1-amine (CID 89098977) is (2S)-2-(methoxymethyl)cyclohexan-1-amine.
What is the SMILES notation for (2S)-2-(methoxymethyl)cyclohexan-1-amine?
The canonical SMILES for (2S)-2-(methoxymethyl)cyclohexan-1-amine is COC[C@H]1CCCCC1N.
What is the InChIKey of (2S)-2-(methoxymethyl)cyclohexan-1-amine?
The InChIKey is DOALQHGDJWRMDD-GVHYBUMESA-N. The full InChI is InChI=1S/C8H17NO/c1-10-6-7-4-2-3-5-8(7)9/h7-8H,2-6,9H2,1H3/t7-,8?/m1/s1.
What are the key properties of (2S)-2-(methoxymethyl)cyclohexan-1-amine?
(2S)-2-(methoxymethyl)cyclohexan-1-amine has a molecular weight of 143.23 g/mol, XLogP of 1.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(methoxymethyl)cyclohexan-1-amine is sourced from PubChem (CID 89098977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).