(1-prop-2-enylcyclohexyl)methanamine

C10H19N — CID 10920716

IUPAC(1-prop-2-enylcyclohexyl)methanamine
SMILESC=CCC1(CN)CCCCC1
InChIInChI=1S/C10H19N/c1-2-6-10(9-11)7-4-3-5-8-10/h2H,1,3-9,11H2
InChIKeyRLTBWXOTEDGIGT-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.47
Rot. Bonds3

About (1-prop-2-enylcyclohexyl)methanamine

(1-prop-2-enylcyclohexyl)methanamine (PubChem CID 10920716) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is (1-prop-2-enylcyclohexyl)methanamine.

Molecular Properties

Compound Name(1-prop-2-enylcyclohexyl)methanamine
PubChem CID10920716
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name(1-prop-2-enylcyclohexyl)methanamine
SMILESC=CCC1(CN)CCCCC1
InChIInChI=1S/C10H19N/c1-2-6-10(9-11)7-4-3-5-8-10/h2H,1,3-9,11H2
InChIKeyRLTBWXOTEDGIGT-UHFFFAOYSA-N
XLogP2.47
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (1-prop-2-enylcyclohexyl)methanamine?
The IUPAC name of (1-prop-2-enylcyclohexyl)methanamine (CID 10920716) is (1-prop-2-enylcyclohexyl)methanamine.
What is the SMILES notation for (1-prop-2-enylcyclohexyl)methanamine?
The canonical SMILES for (1-prop-2-enylcyclohexyl)methanamine is C=CCC1(CN)CCCCC1.
What is the InChIKey of (1-prop-2-enylcyclohexyl)methanamine?
The InChIKey is RLTBWXOTEDGIGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-2-6-10(9-11)7-4-3-5-8-10/h2H,1,3-9,11H2.
What are the key properties of (1-prop-2-enylcyclohexyl)methanamine?
(1-prop-2-enylcyclohexyl)methanamine has a molecular weight of 153.27 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1-prop-2-enylcyclohexyl)methanamine is sourced from PubChem (CID 10920716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).