2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine

C13H28N2 — CID 166735065

IUPAC2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine
SMILESCNC(C)C(CC(C)N)C1CCC(C)C1
InChIInChI=1S/C13H28N2/c1-9-5-6-12(7-9)13(8-10(2)14)11(3)15-4/h9-13,15H,5-8,14H2,1-4H3
InChIKeyFTDKYWGNRPDZHF-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.38
Rot. Bonds5

About 2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine

2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine (PubChem CID 166735065) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine.

Molecular Properties

Compound Name2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine
PubChem CID166735065
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine
SMILESCNC(C)C(CC(C)N)C1CCC(C)C1
InChIInChI=1S/C13H28N2/c1-9-5-6-12(7-9)13(8-10(2)14)11(3)15-4/h9-13,15H,5-8,14H2,1-4H3
InChIKeyFTDKYWGNRPDZHF-UHFFFAOYSA-N
XLogP2.38
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-N-methyl-3-(3-methylcyclopentyl)pentane-2,4-diamine
CID 166734994
1-(3,5-dimethylcycloheptyl)propan-1-amine
CID 145017744
1-methyl-3-(3-methylheptan-4-yl)cyclopentane
CID 143344172
4-amino-3-(3-methylcyclohexyl)pentan-1-ol
CID 66090063
1-(3-methylcyclopentyl)butan-1-amine
CID 65414567
[2-methyl-1-(3-methylcyclopentyl)propyl]hydrazine
CID 105233167
1-(4-ethylcyclohexyl)-N-methyl-1-(3-methylcyclopentyl)methanamine
CID 65413158
(1R)-N-methyl-1-(4-methylcyclohexyl)ethanamine
CID 94033456
cis-(1S,3R)-1-methyl-3-propan-2-ylcyclopentane;ethane;hydrofluoride
CID 169140803
1-(3-methylcyclopentyl)ethanol
CID 12501270
2-cyclopentyl-1-(3-methylcyclopentyl)ethanamine
CID 65413957
1-N-(3-methylcyclopentyl)propane-1,2-diamine
CID 114547299

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine?
The IUPAC name of 2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine (CID 166735065) is 2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine.
What is the SMILES notation for 2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine?
The canonical SMILES for 2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine is CNC(C)C(CC(C)N)C1CCC(C)C1.
What is the InChIKey of 2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine?
The InChIKey is FTDKYWGNRPDZHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-9-5-6-12(7-9)13(8-10(2)14)11(3)15-4/h9-13,15H,5-8,14H2,1-4H3.
What are the key properties of 2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine?
2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine has a molecular weight of 212.38 g/mol, XLogP of 2.38, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-3-(3-methylcyclopentyl)hexane-2,5-diamine is sourced from PubChem (CID 166735065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).