1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine

C19H23NO — CID 65410502

IUPAC1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine
SMILESCCNC(Cc1ccccc1)C1COc2ccccc2C1
InChIInChI=1S/C19H23NO/c1-2-20-18(12-15-8-4-3-5-9-15)17-13-16-10-6-7-11-19(16)21-14-17/h3-11,17-18,20H,2,12-14H2,1H3
InChIKeyKUYYGPYPEAQSGY-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.46
Rot. Bonds5

About 1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine

1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine (PubChem CID 65410502) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine.

Molecular Properties

Compound Name1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine
PubChem CID65410502
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine
SMILESCCNC(Cc1ccccc1)C1COc2ccccc2C1
InChIInChI=1S/C19H23NO/c1-2-20-18(12-15-8-4-3-5-9-15)17-13-16-10-6-7-11-19(16)21-14-17/h3-11,17-18,20H,2,12-14H2,1H3
InChIKeyKUYYGPYPEAQSGY-UHFFFAOYSA-N
XLogP3.46
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3,4-dihydro-2H-chromen-3-yl)-N-ethylbut-3-en-1-amine
CID 65412063
1-(3,4-dihydro-2H-chromen-3-yl)-N-ethylpent-3-yn-1-amine
CID 65410110
1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-5-methylhexan-1-amine
CID 83161048
1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-methylprop-2-en-1-amine
CID 79180444
1-(3,4-dihydro-2H-chromen-3-yl)-4-methyl-N-propylpentan-1-amine
CID 65411094
1-(3,4-dihydro-2H-chromen-3-yl)-2-(5-ethylthiophen-2-yl)-N-methylethanamine
CID 65410299
1-(3,4-dihydro-2H-chromen-3-yl)-N-propylheptan-1-amine
CID 65411679
N-[1-(3,4-dihydro-2H-chromen-3-yl)-2-(1,3-thiazol-2-yl)ethyl]propan-1-amine
CID 79826944
1-(3,4-dihydro-2H-chromen-3-yl)hexylhydrazine
CID 105234038
N-[cyclohexen-1-yl(3,4-dihydro-2H-chromen-3-yl)methyl]ethanamine
CID 106653327
N-[3,4-dihydro-2H-chromen-3-yl(oxan-3-yl)methyl]ethanamine
CID 107136471
1-(3,4-dihydro-2H-chromen-3-yl)nonylhydrazine
CID 105233938

Frequently Asked Questions

What is the IUPAC name of 1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine?
The IUPAC name of 1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine (CID 65410502) is 1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine.
What is the SMILES notation for 1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine?
The canonical SMILES for 1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine is CCNC(Cc1ccccc1)C1COc2ccccc2C1.
What is the InChIKey of 1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine?
The InChIKey is KUYYGPYPEAQSGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-2-20-18(12-15-8-4-3-5-9-15)17-13-16-10-6-7-11-19(16)21-14-17/h3-11,17-18,20H,2,12-14H2,1H3.
What are the key properties of 1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine?
1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine has a molecular weight of 281.40 g/mol, XLogP of 3.46, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,4-dihydro-2H-chromen-3-yl)-N-ethyl-2-phenylethanamine is sourced from PubChem (CID 65410502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).