N-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine

C11H24N2O — CID 80544285

IUPACN-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine
SMILESCOCCN(CC(C)CCN)C1CC1
InChIInChI=1S/C11H24N2O/c1-10(5-6-12)9-13(7-8-14-2)11-3-4-11/h10-11H,3-9,12H2,1-2H3
InChIKeyDSESYQHRPOOKAQ-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.08
Rot. Bonds8

About N-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine

N-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine (PubChem CID 80544285) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine
PubChem CID80544285
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC NameN-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine
SMILESCOCCN(CC(C)CCN)C1CC1
InChIInChI=1S/C11H24N2O/c1-10(5-6-12)9-13(7-8-14-2)11-3-4-11/h10-11H,3-9,12H2,1-2H3
InChIKeyDSESYQHRPOOKAQ-UHFFFAOYSA-N
XLogP1.08
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromo-2-methylpropyl)-N-(2-methoxyethyl)cyclopropanamine
CID 64996287
4-N-(2-methoxyethyl)-4-N-(2-methylpropyl)cyclohexane-1,4-diamine
CID 62806205
N-(2,2-dimethoxyethyl)-N-(2-methoxyethyl)cyclopropanamine
CID 66222965
3-[cyclopropyl(2-methoxyethyl)amino]-N'-hydroxy-2-methylpropanimidamide
CID 61451610
N'-cyclopropyl-2-methyl-N'-(3-methylbutyl)propane-1,3-diamine
CID 78973832
3-[cyclopropyl(2-methoxyethyl)amino]-2-methylpropanehydrazide
CID 63583449
N'-cyclopropyl-N'-(2-methoxyethyl)but-2-ene-1,4-diamine
CID 77110360
N'-cyclobutyl-N'-[2-(3-methoxypropoxy)ethyl]ethane-1,2-diamine
CID 103184116
N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine
CID 104561146
1-N-cyclopropyl-5-methoxy-1-N-(3-methylbutyl)pentane-1,2-diamine
CID 81101876
1-N-cyclopropyl-1-N-(2-methoxyethyl)-4,4-dimethylpentane-1,3-diamine
CID 62624688
N'-cyclopropyl-N'-[2-(2-methylpropoxy)ethyl]ethane-1,2-diamine
CID 106450873

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine?
The IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine (CID 80544285) is N-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine.
What is the SMILES notation for N-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine?
The canonical SMILES for N-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine is COCCN(CC(C)CCN)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine?
The InChIKey is DSESYQHRPOOKAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-10(5-6-12)9-13(7-8-14-2)11-3-4-11/h10-11H,3-9,12H2,1-2H3.
What are the key properties of N-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine?
N-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine has a molecular weight of 200.33 g/mol, XLogP of 1.08, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-methoxyethyl)-2-methylbutane-1,4-diamine is sourced from PubChem (CID 80544285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).