(3-methylcyclohexylidene)methanamine

C8H15N — CID 67680642

IUPAC(3-methylcyclohexylidene)methanamine
SMILESCC1CCCC(=CN)C1
InChIInChI=1S/C8H15N/c1-7-3-2-4-8(5-7)6-9/h6-7H,2-5,9H2,1H3
InChIKeyCNVAZFUALDLDHS-UHFFFAOYSA-N
MW125.21 g/mol
LogP2.04
Rot. Bonds

About (3-methylcyclohexylidene)methanamine

(3-methylcyclohexylidene)methanamine (PubChem CID 67680642) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is (3-methylcyclohexylidene)methanamine.

Molecular Properties

Compound Name(3-methylcyclohexylidene)methanamine
PubChem CID67680642
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC Name(3-methylcyclohexylidene)methanamine
SMILESCC1CCCC(=CN)C1
InChIInChI=1S/C8H15N/c1-7-3-2-4-8(5-7)6-9/h6-7H,2-5,9H2,1H3
InChIKeyCNVAZFUALDLDHS-UHFFFAOYSA-N
XLogP2.04
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3-methylcyclohexylidene)methanamine?
The IUPAC name of (3-methylcyclohexylidene)methanamine (CID 67680642) is (3-methylcyclohexylidene)methanamine.
What is the SMILES notation for (3-methylcyclohexylidene)methanamine?
The canonical SMILES for (3-methylcyclohexylidene)methanamine is CC1CCCC(=CN)C1.
What is the InChIKey of (3-methylcyclohexylidene)methanamine?
The InChIKey is CNVAZFUALDLDHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-7-3-2-4-8(5-7)6-9/h6-7H,2-5,9H2,1H3.
What are the key properties of (3-methylcyclohexylidene)methanamine?
(3-methylcyclohexylidene)methanamine has a molecular weight of 125.21 g/mol, XLogP of 2.04, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylcyclohexylidene)methanamine is sourced from PubChem (CID 67680642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).