N-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine

C15H29N — CID 80693580

IUPACN-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine
SMILESCC1CCCC(NC2CCC(C)(C)C2)C1C
InChIInChI=1S/C15H29N/c1-11-6-5-7-14(12(11)2)16-13-8-9-15(3,4)10-13/h11-14,16H,5-10H2,1-4H3
InChIKeyARCNOLWQPHJTFW-UHFFFAOYSA-N
MW223.40 g/mol
LogP3.98
Rot. Bonds2

About N-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine

N-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine (PubChem CID 80693580) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is N-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine
PubChem CID80693580
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC NameN-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine
SMILESCC1CCCC(NC2CCC(C)(C)C2)C1C
InChIInChI=1S/C15H29N/c1-11-6-5-7-14(12(11)2)16-13-8-9-15(3,4)10-13/h11-14,16H,5-10H2,1-4H3
InChIKeyARCNOLWQPHJTFW-UHFFFAOYSA-N
XLogP3.98
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine?
The IUPAC name of N-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine (CID 80693580) is N-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine.
What is the SMILES notation for N-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine?
The canonical SMILES for N-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine is CC1CCCC(NC2CCC(C)(C)C2)C1C.
What is the InChIKey of N-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine?
The InChIKey is ARCNOLWQPHJTFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-11-6-5-7-14(12(11)2)16-13-8-9-15(3,4)10-13/h11-14,16H,5-10H2,1-4H3.
What are the key properties of N-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine?
N-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine has a molecular weight of 223.40 g/mol, XLogP of 3.98, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylcyclopentyl)-2,3-dimethylcyclohexan-1-amine is sourced from PubChem (CID 80693580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).