N-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine

C11H24N2O — CID 65175083

IUPACN-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine
SMILESCCOCCCN(C)CCNC1CC1
InChIInChI=1S/C11H24N2O/c1-3-14-10-4-8-13(2)9-7-12-11-5-6-11/h11-12H,3-10H2,1-2H3
InChIKeyVKSBPIMGWNNXOD-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.10
Rot. Bonds9

About N-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine

N-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine (PubChem CID 65175083) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is N-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine
PubChem CID65175083
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC NameN-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine
SMILESCCOCCCN(C)CCNC1CC1
InChIInChI=1S/C11H24N2O/c1-3-14-10-4-8-13(2)9-7-12-11-5-6-11/h11-12H,3-10H2,1-2H3
InChIKeyVKSBPIMGWNNXOD-UHFFFAOYSA-N
XLogP1.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopropyl-N'-methyl-N'-[3-(2,2,2-trifluoroethoxy)propyl]ethane-1,2-diamine
CID 55002465
N'-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-N-cyclopropyl-N'-methylethane-1,2-diamine
CID 104563816
N-[3-(2-ethoxyethoxy)propyl]cyclopropanamine
CID 62445452
1-N-cyclopropyl-3-N-(2-ethoxyethyl)-3-N-methylbutane-1,3-diamine
CID 81074188
N-cyclopropyl-N',N'-bis(2-ethoxyethyl)hexane-1,6-diamine
CID 82940250
N',N'-bis(2-ethoxyethyl)-N-(4-methylcyclohexyl)ethane-1,2-diamine
CID 82943267
N-cyclopropyl-N'-methyl-N'-pentylbutane-1,4-diamine
CID 62420379
N'-(3-ethoxypropyl)-N-(2-methoxyethyl)-N'-methylethane-1,2-diamine
CID 65175029
N-cyclohexyl-N'-methyl-N'-pentylethane-1,2-diamine
CID 62574766
N'-(3-ethoxypropyl)-N'-methyl-N-(2-methylpropyl)ethane-1,2-diamine
CID 65175588
N'-(2-ethoxyethyl)-N'-ethyl-N-(4-methylcyclohexyl)ethane-1,2-diamine
CID 63691083
N-(2-ethoxyethyl)-4-methylcyclohexan-1-amine
CID 43387964

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine?
The IUPAC name of N-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine (CID 65175083) is N-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine.
What is the SMILES notation for N-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine?
The canonical SMILES for N-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine is CCOCCCN(C)CCNC1CC1.
What is the InChIKey of N-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine?
The InChIKey is VKSBPIMGWNNXOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-3-14-10-4-8-13(2)9-7-12-11-5-6-11/h11-12H,3-10H2,1-2H3.
What are the key properties of N-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine?
N-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine has a molecular weight of 200.33 g/mol, XLogP of 1.10, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N'-(3-ethoxypropyl)-N'-methylethane-1,2-diamine is sourced from PubChem (CID 65175083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).