N-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine

C15H29N — CID 79856410

IUPACN-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine
SMILESCC1(C)CCC(NC2CCCC2(C)C)CC1
InChIInChI=1S/C15H29N/c1-14(2)10-7-12(8-11-14)16-13-6-5-9-15(13,3)4/h12-13,16H,5-11H2,1-4H3
InChIKeyHCGWWSJFDIDXEI-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.12
Rot. Bonds2

About N-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine

N-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine (PubChem CID 79856410) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is N-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine
PubChem CID79856410
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC NameN-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine
SMILESCC1(C)CCC(NC2CCCC2(C)C)CC1
InChIInChI=1S/C15H29N/c1-14(2)10-7-12(8-11-14)16-13-6-5-9-15(13,3)4/h12-13,16H,5-11H2,1-4H3
InChIKeyHCGWWSJFDIDXEI-UHFFFAOYSA-N
XLogP4.12
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 ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine?
The IUPAC name of N-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine (CID 79856410) is N-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine.
What is the SMILES notation for N-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine?
The canonical SMILES for N-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine is CC1(C)CCC(NC2CCCC2(C)C)CC1.
What is the InChIKey of N-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine?
The InChIKey is HCGWWSJFDIDXEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-14(2)10-7-12(8-11-14)16-13-6-5-9-15(13,3)4/h12-13,16H,5-11H2,1-4H3.
What are the key properties of N-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine?
N-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine has a molecular weight of 223.40 g/mol, XLogP of 4.12, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethylcyclopentyl)-4,4-dimethylcyclohexan-1-amine is sourced from PubChem (CID 79856410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).