N,N'-dicyclopentyl-N'-methylethane-1,2-diamine

C13H26N2 — CID 60850716

IUPACN,N'-dicyclopentyl-N'-methylethane-1,2-diamine
SMILESCN(CCNC1CCCC1)C1CCCC1
InChIInChI=1S/C13H26N2/c1-15(13-8-4-5-9-13)11-10-14-12-6-2-3-7-12/h12-14H,2-11H2,1H3
InChIKeyAPCDUTCWDFCNIU-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.39
Rot. Bonds5

About N,N'-dicyclopentyl-N'-methylethane-1,2-diamine

N,N'-dicyclopentyl-N'-methylethane-1,2-diamine (PubChem CID 60850716) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N,N'-dicyclopentyl-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN,N'-dicyclopentyl-N'-methylethane-1,2-diamine
PubChem CID60850716
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN,N'-dicyclopentyl-N'-methylethane-1,2-diamine
SMILESCN(CCNC1CCCC1)C1CCCC1
InChIInChI=1S/C13H26N2/c1-15(13-8-4-5-9-13)11-10-14-12-6-2-3-7-12/h12-14H,2-11H2,1H3
InChIKeyAPCDUTCWDFCNIU-UHFFFAOYSA-N
XLogP2.39
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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

N'-cyclohexyl-N'-methyl-N-(oxan-4-yl)ethane-1,2-diamine
CID 63098109
N'-cyclopentyl-N'-methyl-N-(3-methylcyclohexyl)ethane-1,2-diamine
CID 62576013
N'-cyclopentyl-N'-methyl-N-spiro[4.5]decan-8-ylethane-1,2-diamine
CID 114817655
N'-cyclopentyl-N'-methyl-N-(4-propylcyclohexyl)ethane-1,2-diamine
CID 63462451
N-cyclopropyl-N'-methyl-N'-(3-methylcyclohexyl)ethane-1,2-diamine
CID 61447072
N-cyclopropyl-N'-(4-ethylcyclohexyl)-N'-methylethane-1,2-diamine
CID 61449433
N',N'-dicyclohexyl-N-cyclopentylethane-1,2-diamine
CID 60851932
N'-cyclopentyl-N'-methyl-N-(3-phenylcyclobutyl)ethane-1,2-diamine
CID 63314496
N'-cyclohexyl-N-(4-ethylcycloheptyl)-N'-methylpropane-1,3-diamine
CID 65083055
N-methyl-N-[2-(4-methylpiperazin-1-yl)ethyl]cycloheptanamine;N-[2-(4-methylpiperazin-1-yl)ethyl]cycloheptanamine
CID 159997450
N'-cyclopentyl-N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)-N'-methylethane-1,2-diamine
CID 115717762
N'-cyclohexyl-N'-methyl-N-(4-propan-2-ylcyclohexyl)propane-1,3-diamine
CID 63451987

Frequently Asked Questions

What is the IUPAC name of N,N'-dicyclopentyl-N'-methylethane-1,2-diamine?
The IUPAC name of N,N'-dicyclopentyl-N'-methylethane-1,2-diamine (CID 60850716) is N,N'-dicyclopentyl-N'-methylethane-1,2-diamine.
What is the SMILES notation for N,N'-dicyclopentyl-N'-methylethane-1,2-diamine?
The canonical SMILES for N,N'-dicyclopentyl-N'-methylethane-1,2-diamine is CN(CCNC1CCCC1)C1CCCC1.
What is the InChIKey of N,N'-dicyclopentyl-N'-methylethane-1,2-diamine?
The InChIKey is APCDUTCWDFCNIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-15(13-8-4-5-9-13)11-10-14-12-6-2-3-7-12/h12-14H,2-11H2,1H3.
What are the key properties of N,N'-dicyclopentyl-N'-methylethane-1,2-diamine?
N,N'-dicyclopentyl-N'-methylethane-1,2-diamine has a molecular weight of 210.36 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dicyclopentyl-N'-methylethane-1,2-diamine is sourced from PubChem (CID 60850716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).