[3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol

C17H19NO3 — CID 43784761

IUPAC[3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol
SMILESCOc1ccc2c(c1)C(Nc1cccc(CO)c1)CCO2
InChIInChI=1S/C17H19NO3/c1-20-14-5-6-17-15(10-14)16(7-8-21-17)18-13-4-2-3-12(9-13)11-19/h2-6,9-10,16,18-19H,7-8,11H2,1H3
InChIKeyDYDPDRIFAVYEEI-UHFFFAOYSA-N
MW285.34 g/mol
LogP3.12
Rot. Bonds4

About [3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol

[3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol (PubChem CID 43784761) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is [3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol.

Molecular Properties

Compound Name[3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol
PubChem CID43784761
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name[3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol
SMILESCOc1ccc2c(c1)C(Nc1cccc(CO)c1)CCO2
InChIInChI=1S/C17H19NO3/c1-20-14-5-6-17-15(10-14)16(7-8-21-17)18-13-4-2-3-12(9-13)11-19/h2-6,9-10,16,18-19H,7-8,11H2,1H3
InChIKeyDYDPDRIFAVYEEI-UHFFFAOYSA-N
XLogP3.12
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol with MolForge

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Related Compounds

N-(3-ethylphenyl)-6-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 43765168
3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]benzonitrile
CID 43762546
N-benzyl-6-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 12851988
6-methoxy-N-(3-methylbut-2-enyl)-3,4-dihydro-2H-chromen-4-amine
CID 103522678
[4-[(7-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]-6-methylpyrimidin-2-yl]methanol
CID 154797001
N-(2-chlorophenyl)-6-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 43763115
(2R)-1-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]propan-2-ol
CID 113349398
2-[2-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]ethoxy]ethanol
CID 43771494
6-methoxy-N-(2-methoxyethyl)-3,4-dihydro-2H-chromen-4-amine
CID 43756306
6-methoxy-N-[(2-methylpropan-2-yl)oxy]-3,4-dihydro-2H-chromen-4-amine
CID 82720276
N-(2,5-dibromophenyl)-6-methoxy-3,4-dihydro-2H-chromen-4-amine
CID 43789312
6-methoxy-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-3,4-dihydro-2H-chromen-4-amine
CID 103904001

Frequently Asked Questions

What is the IUPAC name of [3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol?
The IUPAC name of [3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol (CID 43784761) is [3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol.
What is the SMILES notation for [3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol?
The canonical SMILES for [3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol is COc1ccc2c(c1)C(Nc1cccc(CO)c1)CCO2.
What is the InChIKey of [3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol?
The InChIKey is DYDPDRIFAVYEEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-20-14-5-6-17-15(10-14)16(7-8-21-17)18-13-4-2-3-12(9-13)11-19/h2-6,9-10,16,18-19H,7-8,11H2,1H3.
What are the key properties of [3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol?
[3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol has a molecular weight of 285.34 g/mol, XLogP of 3.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(6-methoxy-3,4-dihydro-2H-chromen-4-yl)amino]phenyl]methanol is sourced from PubChem (CID 43784761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).