1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine

C18H24N2O2 — CID 67831126

IUPAC1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine
SMILESCOc1ccccc1N(C)C(Cc1ccccc1)C(N)OC
InChIInChI=1S/C18H24N2O2/c1-20(15-11-7-8-12-17(15)21-2)16(18(19)22-3)13-14-9-5-4-6-10-14/h4-12,16,18H,13,19H2,1-3H3
InChIKeyGZIWUPCZSRWCBD-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.67
Rot. Bonds7

About 1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine

1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine (PubChem CID 67831126) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine.

Molecular Properties

Compound Name1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine
PubChem CID67831126
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine
SMILESCOc1ccccc1N(C)C(Cc1ccccc1)C(N)OC
InChIInChI=1S/C18H24N2O2/c1-20(15-11-7-8-12-17(15)21-2)16(18(19)22-3)13-14-9-5-4-6-10-14/h4-12,16,18H,13,19H2,1-3H3
InChIKeyGZIWUPCZSRWCBD-UHFFFAOYSA-N
XLogP2.67
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine?
The IUPAC name of 1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine (CID 67831126) is 1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine.
What is the SMILES notation for 1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine?
The canonical SMILES for 1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine is COc1ccccc1N(C)C(Cc1ccccc1)C(N)OC.
What is the InChIKey of 1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine?
The InChIKey is GZIWUPCZSRWCBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-20(15-11-7-8-12-17(15)21-2)16(18(19)22-3)13-14-9-5-4-6-10-14/h4-12,16,18H,13,19H2,1-3H3.
What are the key properties of 1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine?
1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine has a molecular weight of 300.40 g/mol, XLogP of 2.67, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-N-(2-methoxyphenyl)-2-N-methyl-3-phenylpropane-1,2-diamine is sourced from PubChem (CID 67831126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).