3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine

C13H26N2 — CID 79644118

IUPAC3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine
SMILESCCNC1CCC(N(C)C2CCCC2)C1
InChIInChI=1S/C13H26N2/c1-3-14-11-8-9-13(10-11)15(2)12-6-4-5-7-12/h11-14H,3-10H2,1-2H3
InChIKeyKYZLLCZMLAXZOL-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.39
Rot. Bonds4

About 3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine

3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine (PubChem CID 79644118) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine.

Molecular Properties

Compound Name3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine
PubChem CID79644118
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine
SMILESCCNC1CCC(N(C)C2CCCC2)C1
InChIInChI=1S/C13H26N2/c1-3-14-11-8-9-13(10-11)15(2)12-6-4-5-7-12/h11-14H,3-10H2,1-2H3
InChIKeyKYZLLCZMLAXZOL-UHFFFAOYSA-N
XLogP2.39
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-N-cyclohexyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine
CID 79642460
1-N-ethyl-3-N-(4-ethylcyclohexyl)-3-N-methylcyclopentane-1,3-diamine
CID 79642724
3-N-cyclopropyl-3-N-methyl-1-N-propylcyclopentane-1,3-diamine
CID 79643528
1-N-cyclohexyl-1-N,3-N-diethylcyclohexane-1,3-diamine
CID 79630666
1-N-ethyl-3-N-methyl-3-N-(3-methylbutan-2-yl)cyclopentane-1,3-diamine
CID 79643301
4-N-(3-ethylcyclohexyl)-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79122835
3-N-methyl-3-N-(1-methylpiperidin-4-yl)-1-N-propylcyclopentane-1,3-diamine
CID 79642701
4-N-cyclooctyl-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 79122769
3-N-methyl-3-N-(2-methylcyclohexyl)-1-N-propylcyclopentane-1,3-diamine
CID 79642486
N-cyclopropyl-N-methylcyclooctanamine
CID 67119180
4-N-(cyclopentylmethyl)-1-N-ethyl-4-N-methylcyclohexane-1,4-diamine
CID 79123042
4-N-cyclopropyl-4-N-methyl-1-N-propylcyclohexane-1,4-diamine
CID 114762819

Frequently Asked Questions

What is the IUPAC name of 3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine?
The IUPAC name of 3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine (CID 79644118) is 3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine.
What is the SMILES notation for 3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine?
The canonical SMILES for 3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine is CCNC1CCC(N(C)C2CCCC2)C1.
What is the InChIKey of 3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine?
The InChIKey is KYZLLCZMLAXZOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-3-14-11-8-9-13(10-11)15(2)12-6-4-5-7-12/h11-14H,3-10H2,1-2H3.
What are the key properties of 3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine?
3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine has a molecular weight of 210.36 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-cyclopentyl-1-N-ethyl-3-N-methylcyclopentane-1,3-diamine is sourced from PubChem (CID 79644118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).