1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine

C16H28N2O2 — CID 62488443

IUPAC1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine
SMILESCOCCN(CC(C)(N)c1ccccc1)C(C)COC
InChIInChI=1S/C16H28N2O2/c1-14(12-20-4)18(10-11-19-3)13-16(2,17)15-8-6-5-7-9-15/h5-9,14H,10-13,17H2,1-4H3
InChIKeyOEUWTRIUQAPCQL-UHFFFAOYSA-N
MW280.41 g/mol
LogP1.84
Rot. Bonds9

About 1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine

1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine (PubChem CID 62488443) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is 1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine
PubChem CID62488443
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC Name1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine
SMILESCOCCN(CC(C)(N)c1ccccc1)C(C)COC
InChIInChI=1S/C16H28N2O2/c1-14(12-20-4)18(10-11-19-3)13-16(2,17)15-8-6-5-7-9-15/h5-9,14H,10-13,17H2,1-4H3
InChIKeyOEUWTRIUQAPCQL-UHFFFAOYSA-N
XLogP1.84
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-[2-methoxyethyl(propan-2-yl)amino]-2-phenylpropanoic acid
CID 82960250
1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2,2-dimethylbutane-1,3-diamine
CID 66453433
1-amino-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-2-methylpropan-2-ol
CID 64821364
methyl 2-amino-3-[2-methoxyethyl(propan-2-yl)amino]-2-phenylpropanoate
CID 82941864
3-[2-methoxyethyl(propan-2-yl)amino]-2-methyl-2-phenylpropanal
CID 82952847
3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]-2,2-dimethylpropan-1-ol
CID 62266357
1-N-methyl-1-N-(3-methylbutyl)-2-phenylpropane-1,2-diamine
CID 62487909
1-N,1-N-dibutyl-2-phenylpropane-1,2-diamine
CID 43829720
3-[2-methoxyethyl(pentan-3-yl)amino]-2-methyl-2-phenylpropanal
CID 62276454
3-[butan-2-yl(2-methoxyethyl)amino]-2,2-dimethyl-1-phenylpropan-1-one
CID 63193802
3-[ethyl(1-methoxypropan-2-yl)amino]-2,2-dimethyl-1-phenylpropan-1-one
CID 63193751
N'-(1-methoxypropan-2-yl)-N',2,2-trimethyl-1-phenylpropane-1,3-diamine
CID 55163332

Frequently Asked Questions

What is the IUPAC name of 1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine?
The IUPAC name of 1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine (CID 62488443) is 1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine.
What is the SMILES notation for 1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine?
The canonical SMILES for 1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine is COCCN(CC(C)(N)c1ccccc1)C(C)COC.
What is the InChIKey of 1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine?
The InChIKey is OEUWTRIUQAPCQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-14(12-20-4)18(10-11-19-3)13-16(2,17)15-8-6-5-7-9-15/h5-9,14H,10-13,17H2,1-4H3.
What are the key properties of 1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine?
1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine has a molecular weight of 280.41 g/mol, XLogP of 1.84, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(2-methoxyethyl)-1-N-(1-methoxypropan-2-yl)-2-phenylpropane-1,2-diamine is sourced from PubChem (CID 62488443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).