N-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine

C15H32N2O2 — CID 82965219

IUPACN-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine
SMILESCCOCCN(CCNC(C)C1CC1)CCOCC
InChIInChI=1S/C15H32N2O2/c1-4-18-12-10-17(11-13-19-5-2)9-8-16-14(3)15-6-7-15/h14-16H,4-13H2,1-3H3
InChIKeyIMALBXJUQBIBRK-UHFFFAOYSA-N
MW272.43 g/mol
LogP1.75
Rot. Bonds13

About N-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine

N-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine (PubChem CID 82965219) has the molecular formula C15H32N2O2 and a molecular weight of 272.43 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine
PubChem CID82965219
Molecular FormulaC15H32N2O2
Molecular Weight272.43 g/mol
Exact Mass272.25
IUPAC NameN-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine
SMILESCCOCCN(CCNC(C)C1CC1)CCOCC
InChIInChI=1S/C15H32N2O2/c1-4-18-12-10-17(11-13-19-5-2)9-8-16-14(3)15-6-7-15/h14-16H,4-13H2,1-3H3
InChIKeyIMALBXJUQBIBRK-UHFFFAOYSA-N
XLogP1.75
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.43
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(1-cyclopropylethyl)-N'-ethyl-N'-propylethane-1,2-diamine
CID 62573810
N-(dicyclopropylmethyl)-N'-(2-ethoxyethyl)-N'-methylethane-1,2-diamine
CID 81067870
N-(1-cyclopropylethyl)-N'-(cyclopropylmethyl)-N'-propylethane-1,2-diamine
CID 62555040
1-cyclopropyl-N',N'-bis(2-ethoxyethyl)propane-1,3-diamine
CID 82954187
1-cyclopropyl-N',N'-bis(2-ethoxyethyl)-N-methylethane-1,2-diamine
CID 82965868
N-(1-cyclopropylethyl)-N'-(2,2-difluorobutyl)-N'-ethylethane-1,2-diamine
CID 131969265
N',N'-bis(2-ethoxyethyl)-N-(4-methylcyclohexyl)ethane-1,2-diamine
CID 82943267
(1S)-1-cyclopropyl-N-ethylethanamine
CID 42056539
1-cyclopropyl-N-(2-methoxyethyl)ethanamine
CID 43190130
N-(1-cyclopropylethyl)-N'-methyl-N'-(4-methylpentan-2-yl)ethane-1,2-diamine
CID 62557377
3-ethoxy-N-[1-(oxolan-3-yl)ethyl]propan-1-amine
CID 115704257
N-cyclopropyl-N',N'-bis(2-ethoxyethyl)hexane-1,6-diamine
CID 82940250

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine?
The IUPAC name of N-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine (CID 82965219) is N-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine.
What is the SMILES notation for N-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine?
The canonical SMILES for N-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine is CCOCCN(CCNC(C)C1CC1)CCOCC.
What is the InChIKey of N-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine?
The InChIKey is IMALBXJUQBIBRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O2/c1-4-18-12-10-17(11-13-19-5-2)9-8-16-14(3)15-6-7-15/h14-16H,4-13H2,1-3H3.
What are the key properties of N-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine?
N-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine has a molecular weight of 272.43 g/mol, XLogP of 1.75, 13 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-N',N'-bis(2-ethoxyethyl)ethane-1,2-diamine is sourced from PubChem (CID 82965219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).