1-N-cyclohexylcyclobutane-1,3-diamine

C10H20N2 — CID 80559420

IUPAC1-N-cyclohexylcyclobutane-1,3-diamine
SMILESNC1CC(NC2CCCCC2)C1
InChIInChI=1S/C10H20N2/c11-8-6-10(7-8)12-9-4-2-1-3-5-9/h8-10,12H,1-7,11H2
InChIKeyFVRUFHCGGVVWKP-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.40
Rot. Bonds2

About 1-N-cyclohexylcyclobutane-1,3-diamine

1-N-cyclohexylcyclobutane-1,3-diamine (PubChem CID 80559420) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-N-cyclohexylcyclobutane-1,3-diamine.

Molecular Properties

Compound Name1-N-cyclohexylcyclobutane-1,3-diamine
PubChem CID80559420
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name1-N-cyclohexylcyclobutane-1,3-diamine
SMILESNC1CC(NC2CCCCC2)C1
InChIInChI=1S/C10H20N2/c11-8-6-10(7-8)12-9-4-2-1-3-5-9/h8-10,12H,1-7,11H2
InChIKeyFVRUFHCGGVVWKP-UHFFFAOYSA-N
XLogP1.40
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-N-cyclopentylcyclohexane-1,4-diamine;dihydrochloride
CID 86277360
N-cyclopropylcyclododecanamine
CID 16776852
N-cyclohexylbicyclo[3.2.0]heptan-3-amine
CID 170206740
N-cyclohexylcyclohexanamine;ethane
CID 67925930
1-N-(1-methylpiperidin-4-yl)cyclobutane-1,3-diamine
CID 80559526
N-(3-methylcyclobutyl)cyclopentanamine
CID 115671682
4-N-[4-[(4-aminocyclohexyl)amino]cyclohexyl]cyclohexane-1,4-diamine
CID 158561416
CID 175698442
CID 175698442
(1R,5S)-N-cyclohexyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 667781
N,4-dicyclohexylcyclohexan-1-amine
CID 70368908
1-N-cyclopentylcycloheptane-1,2-diamine
CID 82933043
1-N-(2-ethylcyclohexyl)cyclobutane-1,3-diamine
CID 80559999

Frequently Asked Questions

What is the IUPAC name of 1-N-cyclohexylcyclobutane-1,3-diamine?
The IUPAC name of 1-N-cyclohexylcyclobutane-1,3-diamine (CID 80559420) is 1-N-cyclohexylcyclobutane-1,3-diamine.
What is the SMILES notation for 1-N-cyclohexylcyclobutane-1,3-diamine?
The canonical SMILES for 1-N-cyclohexylcyclobutane-1,3-diamine is NC1CC(NC2CCCCC2)C1.
What is the InChIKey of 1-N-cyclohexylcyclobutane-1,3-diamine?
The InChIKey is FVRUFHCGGVVWKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c11-8-6-10(7-8)12-9-4-2-1-3-5-9/h8-10,12H,1-7,11H2.
What are the key properties of 1-N-cyclohexylcyclobutane-1,3-diamine?
1-N-cyclohexylcyclobutane-1,3-diamine has a molecular weight of 168.28 g/mol, XLogP of 1.40, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-cyclohexylcyclobutane-1,3-diamine is sourced from PubChem (CID 80559420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).