N'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine

C15H30N2 — CID 104745297

IUPACN'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine
SMILESCCCCN(CC(NC)C1CCCC1)C1CC1
InChIInChI=1S/C15H30N2/c1-3-4-11-17(14-9-10-14)12-15(16-2)13-7-5-6-8-13/h13-16H,3-12H2,1-2H3
InChIKeyIMNIBGVJYVWSHF-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.03
Rot. Bonds8

About N'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine

N'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine (PubChem CID 104745297) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine.

Molecular Properties

Compound NameN'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine
PubChem CID104745297
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine
SMILESCCCCN(CC(NC)C1CCCC1)C1CC1
InChIInChI=1S/C15H30N2/c1-3-4-11-17(14-9-10-14)12-15(16-2)13-7-5-6-8-13/h13-16H,3-12H2,1-2H3
InChIKeyIMNIBGVJYVWSHF-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N',1-dicyclopentyl-N-methyl-N'-(3-methylbutyl)ethane-1,2-diamine
CID 104746796
N',1-dicyclopropyl-N'-ethyl-N-methylethane-1,2-diamine
CID 63913422
N',N'-dibutyl-1-cyclopropyl-N-methylethane-1,2-diamine
CID 63912327
N'-cyclohexyl-1-cyclopropyl-N'-ethyl-N-methylethane-1,2-diamine
CID 63912104
1-cyclopentyl-N'-ethyl-N-methyl-N'-propylethane-1,2-diamine
CID 104744662
(2R)-1-N-butyl-1-N-cyclopropylpropane-1,2-diamine
CID 103934535
1-cyclohexyl-N'-cyclopropyl-N,N'-dimethylethane-1,2-diamine
CID 104744627
N'-[2-cyclopentyl-2-(methylamino)ethyl]-N,N,N'-triethylpropane-1,3-diamine
CID 102992550
N-butyl-N-(2,2-dimethoxyethyl)cyclopropanamine
CID 66222322
1-cyclohexyl-N'-cyclopropyl-N,N'-diethylethane-1,2-diamine
CID 104744610
N-butyl-N-propylcyclohexanamine
CID 15751893
N',N'-dibutyl-1-cyclohexyl-N-propylethane-1,2-diamine
CID 104744588

Frequently Asked Questions

What is the IUPAC name of N'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine?
The IUPAC name of N'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine (CID 104745297) is N'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine.
What is the SMILES notation for N'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine?
The canonical SMILES for N'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine is CCCCN(CC(NC)C1CCCC1)C1CC1.
What is the InChIKey of N'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine?
The InChIKey is IMNIBGVJYVWSHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-3-4-11-17(14-9-10-14)12-15(16-2)13-7-5-6-8-13/h13-16H,3-12H2,1-2H3.
What are the key properties of N'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine?
N'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine has a molecular weight of 238.42 g/mol, XLogP of 3.03, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-butyl-1-cyclopentyl-N'-cyclopropyl-N-methylethane-1,2-diamine is sourced from PubChem (CID 104745297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).