2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine

C8H18N2O — CID 103225536

IUPAC2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine
SMILESCOCC(CN)N(C)C1CC1
InChIInChI=1S/C8H18N2O/c1-10(7-3-4-7)8(5-9)6-11-2/h7-8H,3-6,9H2,1-2H3
InChIKeyNICMOKKAGRSVPX-UHFFFAOYSA-N
MW158.24 g/mol
LogP0.05
Rot. Bonds5

About 2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine

2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine (PubChem CID 103225536) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine
PubChem CID103225536
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine
SMILESCOCC(CN)N(C)C1CC1
InChIInChI=1S/C8H18N2O/c1-10(7-3-4-7)8(5-9)6-11-2/h7-8H,3-6,9H2,1-2H3
InChIKeyNICMOKKAGRSVPX-UHFFFAOYSA-N
XLogP0.05
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 50.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-cyclobutyl-1-N-ethyl-3-methoxy-2-N-methylpropane-1,2-diamine
CID 103227279
3-methoxy-2-N-methyl-2-N-(4-methylcyclohexyl)-1-N-propylpropane-1,2-diamine
CID 103224985
3-amino-2-[cycloheptyl(methyl)amino]propan-1-ol
CID 104710851
2-N-cyclopentyl-2-N,4,4-trimethylpentane-1,2-diamine
CID 62951525
3-methoxy-2-N-methyl-2-N-(3-methylbutan-2-yl)propane-1,2-diamine
CID 103225710
2-N-(4,4-dimethylcyclohexyl)-1-N-ethyl-3-methoxy-2-N-methylpropane-1,2-diamine
CID 103226991
2-N-(4,4-dimethylcyclohexyl)-3-methoxy-2-N-methyl-1-N-propan-2-ylpropane-1,2-diamine
CID 103226992
2-N-methyl-2-N-(4-methylcyclohexyl)-4-methylsulfanylbutane-1,2-diamine
CID 61439507
2-N-cyclopropyl-1-N-(1-methoxy-3-methylbutan-2-yl)-2-N-methylpropane-1,2-diamine
CID 115717680
1-N-ethyl-2-N-(1-ethylpiperidin-4-yl)-3-methoxy-2-N-methylpropane-1,2-diamine
CID 103226137
2-N-(1-ethylpiperidin-4-yl)-4-methoxy-2-N,4-dimethylpentane-1,2-diamine
CID 106675628
tert-butyl N-[3-amino-2-[cyclopropyl(methyl)amino]propyl]carbamate
CID 102729530

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine?
The IUPAC name of 2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine (CID 103225536) is 2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine.
What is the SMILES notation for 2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine?
The canonical SMILES for 2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine is COCC(CN)N(C)C1CC1.
What is the InChIKey of 2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine?
The InChIKey is NICMOKKAGRSVPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-10(7-3-4-7)8(5-9)6-11-2/h7-8H,3-6,9H2,1-2H3.
What are the key properties of 2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine?
2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine has a molecular weight of 158.24 g/mol, XLogP of 0.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-3-methoxy-2-N-methylpropane-1,2-diamine is sourced from PubChem (CID 103225536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).