N,4-dicyclohexylcyclohexan-1-amine

C18H33N — CID 70368908

IUPACN,4-dicyclohexylcyclohexan-1-amine
SMILESC1CCC(NC2CCC(C3CCCCC3)CC2)CC1
InChIInChI=1S/C18H33N/c1-3-7-15(8-4-1)16-11-13-18(14-12-16)19-17-9-5-2-6-10-17/h15-19H,1-14H2
InChIKeyPXOXFWQSWLIURK-UHFFFAOYSA-N
MW263.47 g/mol
LogP5.05
Rot. Bonds3

About N,4-dicyclohexylcyclohexan-1-amine

N,4-dicyclohexylcyclohexan-1-amine (PubChem CID 70368908) has the molecular formula C18H33N and a molecular weight of 263.47 g/mol. Its IUPAC name is N,4-dicyclohexylcyclohexan-1-amine.

Molecular Properties

Compound NameN,4-dicyclohexylcyclohexan-1-amine
PubChem CID70368908
Molecular FormulaC18H33N
Molecular Weight263.47 g/mol
Exact Mass263.26
IUPAC NameN,4-dicyclohexylcyclohexan-1-amine
SMILESC1CCC(NC2CCC(C3CCCCC3)CC2)CC1
InChIInChI=1S/C18H33N/c1-3-7-15(8-4-1)16-11-13-18(14-12-16)19-17-9-5-2-6-10-17/h15-19H,1-14H2
InChIKeyPXOXFWQSWLIURK-UHFFFAOYSA-N
XLogP5.05
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500263.47
LogP ≤ 55.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-cyclopropylcyclododecanamine
CID 16776852
N-[4-[4-(cyclohexylamino)cyclohexyl]cyclohexyl]-4-methylcyclohexan-1-amine
CID 118983920
N,3-dicyclopropylcyclohexan-1-amine
CID 64594632
N-cyclohexylbicyclo[3.2.0]heptan-3-amine
CID 170206740
N-methylbicyclo[8.7.0]heptadecan-13-amine
CID 170240030
N-cyclopropyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-amine
CID 83906410
N-cyclohexylcyclohexanamine;ethane
CID 67925930
1-cyclohexyl-4-[4-[4-[4-[4-(4-cyclohexylcyclohexyl)cyclohexyl]cyclohexyl]cyclohexyl]cyclohexyl]cyclohexane
CID 123286414
tricyclo[11.9.0.05,8]docosane
CID 123241919
hexacyclo[23.22.0.05,20.08,15.028,44.032,40]heptatetracontane
CID 123895586
pentacyclo[23.18.0.05,21.08,16.029,41]tritetracontane
CID 123459742
cyclohexylcycloheptane
CID 524589

Frequently Asked Questions

What is the IUPAC name of N,4-dicyclohexylcyclohexan-1-amine?
The IUPAC name of N,4-dicyclohexylcyclohexan-1-amine (CID 70368908) is N,4-dicyclohexylcyclohexan-1-amine.
What is the SMILES notation for N,4-dicyclohexylcyclohexan-1-amine?
The canonical SMILES for N,4-dicyclohexylcyclohexan-1-amine is C1CCC(NC2CCC(C3CCCCC3)CC2)CC1.
What is the InChIKey of N,4-dicyclohexylcyclohexan-1-amine?
The InChIKey is PXOXFWQSWLIURK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N/c1-3-7-15(8-4-1)16-11-13-18(14-12-16)19-17-9-5-2-6-10-17/h15-19H,1-14H2.
What are the key properties of N,4-dicyclohexylcyclohexan-1-amine?
N,4-dicyclohexylcyclohexan-1-amine has a molecular weight of 263.47 g/mol, XLogP of 5.05, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dicyclohexylcyclohexan-1-amine is sourced from PubChem (CID 70368908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).