N'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine

C14H28N2 — CID 61344091

IUPACN'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine
SMILESNCCCN(CC1CCCC1)C1CCCC1
InChIInChI=1S/C14H28N2/c15-10-5-11-16(14-8-3-4-9-14)12-13-6-1-2-7-13/h13-14H,1-12,15H2
InChIKeyLEJHUNUXMLGJQF-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.77
Rot. Bonds6

About N'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine

N'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine (PubChem CID 61344091) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine
PubChem CID61344091
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine
SMILESNCCCN(CC1CCCC1)C1CCCC1
InChIInChI=1S/C14H28N2/c15-10-5-11-16(14-8-3-4-9-14)12-13-6-1-2-7-13/h13-14H,1-12,15H2
InChIKeyLEJHUNUXMLGJQF-UHFFFAOYSA-N
XLogP2.77
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-cyclobutyl-N'-(cyclobutylmethyl)propane-1,3-diamine
CID 102875057
N-(3-chloropropyl)-N-(cyclopentylmethyl)cyclobutanamine
CID 102860573
N-butyl-N-(cyclohexylmethyl)cyclohexanamine;hydrochloride
CID 174640221
N'-cyclobutyl-N'-[(3,3-difluorocyclopentyl)methyl]propane-1,3-diamine
CID 114225230
N'-cyclopentyl-N'-(oxan-2-ylmethyl)propane-1,3-diamine
CID 43591816
N-(2-bromoethyl)-N-(cyclobutylmethyl)cyclopentanamine
CID 80672742
N'-cyclopentyl-N'-nonylpropane-1,3-diamine
CID 43319594
N'-cyclopentyl-N'-hexylpropane-1,3-diamine
CID 43137589
N'-cyclohexyl-N'-heptylpropane-1,3-diamine
CID 43137640
N'-cyclobutyl-N'-cyclopentylpropane-1,3-diamine
CID 102874978
N'-cyclopentyl-N'-[(4-methylmorpholin-2-yl)methyl]propane-1,3-diamine
CID 79172179
N'-cyclopentyl-N'-(1-oxaspiro[4.4]nonan-2-ylmethyl)propane-1,3-diamine
CID 102896430

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine?
The IUPAC name of N'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine (CID 61344091) is N'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine.
What is the SMILES notation for N'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine?
The canonical SMILES for N'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine is NCCCN(CC1CCCC1)C1CCCC1.
What is the InChIKey of N'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine?
The InChIKey is LEJHUNUXMLGJQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c15-10-5-11-16(14-8-3-4-9-14)12-13-6-1-2-7-13/h13-14H,1-12,15H2.
What are the key properties of N'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine?
N'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine has a molecular weight of 224.39 g/mol, XLogP of 2.77, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N'-(cyclopentylmethyl)propane-1,3-diamine is sourced from PubChem (CID 61344091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).