1-N,2-N-dicyclohexylpropane-1,2-diamine

C15H30N2 — CID 22765259

IUPAC1-N,2-N-dicyclohexylpropane-1,2-diamine
SMILESCC(CNC1CCCCC1)NC1CCCCC1
InChIInChI=1S/C15H30N2/c1-13(17-15-10-6-3-7-11-15)12-16-14-8-4-2-5-9-14/h13-17H,2-12H2,1H3
InChIKeyGXDMOWVVJJERNA-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.22
Rot. Bonds5

About 1-N,2-N-dicyclohexylpropane-1,2-diamine

1-N,2-N-dicyclohexylpropane-1,2-diamine (PubChem CID 22765259) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1-N,2-N-dicyclohexylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N,2-N-dicyclohexylpropane-1,2-diamine
PubChem CID22765259
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1-N,2-N-dicyclohexylpropane-1,2-diamine
SMILESCC(CNC1CCCCC1)NC1CCCCC1
InChIInChI=1S/C15H30N2/c1-13(17-15-10-6-3-7-11-15)12-16-14-8-4-2-5-9-14/h13-17H,2-12H2,1H3
InChIKeyGXDMOWVVJJERNA-UHFFFAOYSA-N
XLogP3.22
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-N,2-N-dicyclohexylpropane-1,2-diamine?
The IUPAC name of 1-N,2-N-dicyclohexylpropane-1,2-diamine (CID 22765259) is 1-N,2-N-dicyclohexylpropane-1,2-diamine.
What is the SMILES notation for 1-N,2-N-dicyclohexylpropane-1,2-diamine?
The canonical SMILES for 1-N,2-N-dicyclohexylpropane-1,2-diamine is CC(CNC1CCCCC1)NC1CCCCC1.
What is the InChIKey of 1-N,2-N-dicyclohexylpropane-1,2-diamine?
The InChIKey is GXDMOWVVJJERNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-13(17-15-10-6-3-7-11-15)12-16-14-8-4-2-5-9-14/h13-17H,2-12H2,1H3.
What are the key properties of 1-N,2-N-dicyclohexylpropane-1,2-diamine?
1-N,2-N-dicyclohexylpropane-1,2-diamine has a molecular weight of 238.42 g/mol, XLogP of 3.22, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,2-N-dicyclohexylpropane-1,2-diamine is sourced from PubChem (CID 22765259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).