1,1-dicyclohexylpropane-1,3-diamine

C15H30N2 — CID 57076927

IUPAC1,1-dicyclohexylpropane-1,3-diamine
SMILESNCCC(N)(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C15H30N2/c16-12-11-15(17,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h13-14H,1-12,16-17H2
InChIKeyFCEIWSGNZTZNCW-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.19
Rot. Bonds4

About 1,1-dicyclohexylpropane-1,3-diamine

1,1-dicyclohexylpropane-1,3-diamine (PubChem CID 57076927) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1,1-dicyclohexylpropane-1,3-diamine.

Molecular Properties

Compound Name1,1-dicyclohexylpropane-1,3-diamine
PubChem CID57076927
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1,1-dicyclohexylpropane-1,3-diamine
SMILESNCCC(N)(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C15H30N2/c16-12-11-15(17,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h13-14H,1-12,16-17H2
InChIKeyFCEIWSGNZTZNCW-UHFFFAOYSA-N
XLogP3.19
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

dichlorotitanium;1,1-dicyclohexylpropane-1,3-diamine
CID 174479679
copper;1,1-di(cyclooctyl)ethane-1,2-diamine
CID 118577975
3-amino-3,3-dicyclohexylpropanenitrile
CID 174404681
2,2,2-tricyclohexylethanamine
CID 57066061
2-cyclohexyl-2-methylpropan-1-amine
CID 19776368
2-cycloheptyl-2-methylpropan-1-amine
CID 82934909
3-cyclopropylbutane-1,3-diamine
CID 150088317
cyclodecyl(iodo)methanediamine
CID 156528266
2-cycloheptatriacontylethanamine
CID 70967764
2-amino-1-cycloheptyl-1-cyclopropylethanol
CID 82928815
2-cyclohexyl-2-cyclopropylpropan-1-amine
CID 83828448
2-cyclohexyl-2-fluoropropane-1,3-diamine;dihydrochloride
CID 122239786

Frequently Asked Questions

What is the IUPAC name of 1,1-dicyclohexylpropane-1,3-diamine?
The IUPAC name of 1,1-dicyclohexylpropane-1,3-diamine (CID 57076927) is 1,1-dicyclohexylpropane-1,3-diamine.
What is the SMILES notation for 1,1-dicyclohexylpropane-1,3-diamine?
The canonical SMILES for 1,1-dicyclohexylpropane-1,3-diamine is NCCC(N)(C1CCCCC1)C1CCCCC1.
What is the InChIKey of 1,1-dicyclohexylpropane-1,3-diamine?
The InChIKey is FCEIWSGNZTZNCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c16-12-11-15(17,13-7-3-1-4-8-13)14-9-5-2-6-10-14/h13-14H,1-12,16-17H2.
What are the key properties of 1,1-dicyclohexylpropane-1,3-diamine?
1,1-dicyclohexylpropane-1,3-diamine has a molecular weight of 238.42 g/mol, XLogP of 3.19, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dicyclohexylpropane-1,3-diamine is sourced from PubChem (CID 57076927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).