N'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane

C11H26N2 — CID 142444471

IUPACN'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane
SMILESCC.CCN(CCNC)C1CCC1
InChIInChI=1S/C9H20N2.C2H6/c1-3-11(8-7-10-2)9-5-4-6-9;1-2/h9-10H,3-8H2,1-2H3;1-2H3
InChIKeyBWCNZUWYTBOKII-UHFFFAOYSA-N
MW186.34 g/mol
LogP2.11
Rot. Bonds5

About N'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane

N'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane (PubChem CID 142444471) has the molecular formula C11H26N2 and a molecular weight of 186.34 g/mol. Its IUPAC name is N'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane.

Molecular Properties

Compound NameN'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane
PubChem CID142444471
Molecular FormulaC11H26N2
Molecular Weight186.34 g/mol
Exact Mass186.21
IUPAC NameN'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane
SMILESCC.CCN(CCNC)C1CCC1
InChIInChI=1S/C9H20N2.C2H6/c1-3-11(8-7-10-2)9-5-4-6-9;1-2/h9-10H,3-8H2,1-2H3;1-2H3
InChIKeyBWCNZUWYTBOKII-UHFFFAOYSA-N
XLogP2.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-cyclohexyl-N-methyl-N'-propylethane-1,2-diamine
CID 82932420
N'-cycloheptyl-N-methyl-N'-propylethane-1,2-diamine
CID 82931038
N,N-diethylcyclobutanamine;ethane
CID 170746144
N-[bis(methylamino)silyl]-N'-cyclopentyl-N'-ethylethane-1,2-diamine
CID 154141406
N'-cyclohexyl-N-(dicyclopropylmethyl)-N'-ethylethane-1,2-diamine
CID 62575722
N'-cyclohexyl-N'-ethyl-N-hexylethane-1,2-diamine
CID 63501797
N-tert-butyl-N'-cyclopropyl-N'-ethylethane-1,2-diamine
CID 61386704
N,N-diethylcycloundecanamine
CID 163828609
N-[2-[cyclopropyl(ethyl)amino]ethyl]-4-(methylamino)butanamide;dihydrochloride
CID 119874340
N'-cyclohexyl-N'-ethyl-N-propan-2-ylbutane-1,4-diamine
CID 55023150
N'-cyclopropyl-N'-ethyl-N-propan-2-ylpropane-1,3-diamine
CID 60852013
N'-cyclohexyl-N-cyclopropyl-N'-ethylpentane-1,5-diamine
CID 62425580

Frequently Asked Questions

What is the IUPAC name of N'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane?
The IUPAC name of N'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane (CID 142444471) is N'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane.
What is the SMILES notation for N'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane?
The canonical SMILES for N'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane is CC.CCN(CCNC)C1CCC1.
What is the InChIKey of N'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane?
The InChIKey is BWCNZUWYTBOKII-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2.C2H6/c1-3-11(8-7-10-2)9-5-4-6-9;1-2/h9-10H,3-8H2,1-2H3;1-2H3.
What are the key properties of N'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane?
N'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane has a molecular weight of 186.34 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclobutyl-N'-ethyl-N-methylethane-1,2-diamine;ethane is sourced from PubChem (CID 142444471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).