3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine

C15H24N2O2 — CID 82965010

IUPAC3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine
SMILESCOCCN(C(C)C)C1COc2ccccc2C1N
InChIInChI=1S/C15H24N2O2/c1-11(2)17(8-9-18-3)13-10-19-14-7-5-4-6-12(14)15(13)16/h4-7,11,13,15H,8-10,16H2,1-3H3
InChIKeyROQDTDADKNQUHP-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.80
Rot. Bonds5

About 3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine

3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine (PubChem CID 82965010) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine.

Molecular Properties

Compound Name3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine
PubChem CID82965010
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine
SMILESCOCCN(C(C)C)C1COc2ccccc2C1N
InChIInChI=1S/C15H24N2O2/c1-11(2)17(8-9-18-3)13-10-19-14-7-5-4-6-12(14)15(13)16/h4-7,11,13,15H,8-10,16H2,1-3H3
InChIKeyROQDTDADKNQUHP-UHFFFAOYSA-N
XLogP1.80
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine?
The IUPAC name of 3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine (CID 82965010) is 3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine.
What is the SMILES notation for 3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine?
The canonical SMILES for 3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine is COCCN(C(C)C)C1COc2ccccc2C1N.
What is the InChIKey of 3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine?
The InChIKey is ROQDTDADKNQUHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)17(8-9-18-3)13-10-19-14-7-5-4-6-12(14)15(13)16/h4-7,11,13,15H,8-10,16H2,1-3H3.
What are the key properties of 3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine?
3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine has a molecular weight of 264.37 g/mol, XLogP of 1.80, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-(2-methoxyethyl)-3-N-propan-2-yl-3,4-dihydro-2H-chromene-3,4-diamine is sourced from PubChem (CID 82965010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).