N'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine

C14H24N2O — CID 55138698

IUPACN'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine
SMILESCC(NCCN(C)C1CCCC1)c1ccco1
InChIInChI=1S/C14H24N2O/c1-12(14-8-5-11-17-14)15-9-10-16(2)13-6-3-4-7-13/h5,8,11-13,15H,3-4,6-7,9-10H2,1-2H3
InChIKeyZWFGKDFYRUNKLF-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.80
Rot. Bonds6

About N'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine

N'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine (PubChem CID 55138698) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is N'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine
PubChem CID55138698
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC NameN'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine
SMILESCC(NCCN(C)C1CCCC1)c1ccco1
InChIInChI=1S/C14H24N2O/c1-12(14-8-5-11-17-14)15-9-10-16(2)13-6-3-4-7-13/h5,8,11-13,15H,3-4,6-7,9-10H2,1-2H3
InChIKeyZWFGKDFYRUNKLF-UHFFFAOYSA-N
XLogP2.80
TPSA28.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(furan-2-yl)ethyl]-N'-methyl-N'-(oxan-4-yl)ethane-1,2-diamine
CID 62560272
N'-(1-ethylpiperidin-4-yl)-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine
CID 62554630
N-(2-cyclopentylethyl)-1-(furan-2-yl)ethanamine
CID 60919683
N-(2-cyclohexylethyl)-1-(furan-2-yl)ethanamine
CID 60919809
N-[1-(5-bromofuran-2-yl)ethyl]-N'-cyclopentyl-N'-methylethane-1,2-diamine
CID 104653000
N'-cyclopentyl-N'-methyl-N-(1-thiophen-2-ylethyl)ethane-1,2-diamine
CID 62574004
N-[1-(furan-2-yl)ethyl]-N'-methyl-N'-propylethane-1,2-diamine
CID 62560734
1-[2-[1-(furan-2-yl)ethylamino]ethyl]-N,N-dimethylpiperidin-4-amine
CID 62561360
N'-cyclopentyl-N-[1-(4-ethylphenyl)ethyl]-N'-methylethane-1,2-diamine
CID 63314482
N'-cyclopropyl-N-[4-(furan-2-yl)butan-2-yl]-N'-methylethane-1,2-diamine
CID 55142379
N'-cyclopropyl-N'-methyl-N-(1-phenylethyl)ethane-1,2-diamine
CID 62975342
N'-(4-fluorophenyl)-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine
CID 62555893

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine?
The IUPAC name of N'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine (CID 55138698) is N'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine.
What is the SMILES notation for N'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine?
The canonical SMILES for N'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine is CC(NCCN(C)C1CCCC1)c1ccco1.
What is the InChIKey of N'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine?
The InChIKey is ZWFGKDFYRUNKLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-12(14-8-5-11-17-14)15-9-10-16(2)13-6-3-4-7-13/h5,8,11-13,15H,3-4,6-7,9-10H2,1-2H3.
What are the key properties of N'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine?
N'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine has a molecular weight of 236.36 g/mol, XLogP of 2.80, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N-[1-(furan-2-yl)ethyl]-N'-methylethane-1,2-diamine is sourced from PubChem (CID 55138698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).