2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one

C17H19NO3 — CID 11737711

IUPAC2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one
SMILESO=c1cc(N2CCOCC2)oc2c3c(ccc12)CCCC3
InChIInChI=1S/C17H19NO3/c19-15-11-16(18-7-9-20-10-8-18)21-17-13-4-2-1-3-12(13)5-6-14(15)17/h5-6,11H,1-4,7-10H2
InChIKeyNTWWPYPJDJHUMF-UHFFFAOYSA-N
MW285.34 g/mol
LogP2.51
Rot. Bonds1

About 2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one

2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one (PubChem CID 11737711) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one.

Molecular Properties

Compound Name2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one
PubChem CID11737711
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one
SMILESO=c1cc(N2CCOCC2)oc2c3c(ccc12)CCCC3
InChIInChI=1S/C17H19NO3/c19-15-11-16(18-7-9-20-10-8-18)21-17-13-4-2-1-3-12(13)5-6-14(15)17/h5-6,11H,1-4,7-10H2
InChIKeyNTWWPYPJDJHUMF-UHFFFAOYSA-N
XLogP2.51
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 52.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 3973
NU-7026
CID 9860529
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CID 3045696
4H-Naphtho(1,2-b)pyran-4-one, 2-(1-piperidinyl)-
CID 3045697
2-(4-Morpholinyl)-4H-1-benzopyran-4-one
CID 131255
2-(2-Methylmorpholin-4-yl)benzo(h)chromen-4-one
CID 10017389
2-morpholino-4H-benzo[g]chromen-4-one
CID 11437483
8-(4-Acetylphenyl)-2-morpholin-4-ylchromen-4-one
CID 11710022
8-Methyl-2-morpholin-4-yl-chromen-4-one
CID 10083230
2-morpholino-8-(2-phenylethynyl)-4H-chromen-4-one
CID 10359339
2-thiomorpholino-4H-benzo[h]chromen-4-one
CID 11174002
8-Phenyl-2-piperidin-1-yl-chromen-4-one
CID 11185819

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one?
The IUPAC name of 2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one (CID 11737711) is 2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one.
What is the SMILES notation for 2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one?
The canonical SMILES for 2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one is O=c1cc(N2CCOCC2)oc2c3c(ccc12)CCCC3.
What is the InChIKey of 2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one?
The InChIKey is NTWWPYPJDJHUMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c19-15-11-16(18-7-9-20-10-8-18)21-17-13-4-2-1-3-12(13)5-6-14(15)17/h5-6,11H,1-4,7-10H2.
What are the key properties of 2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one?
2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one has a molecular weight of 285.34 g/mol, XLogP of 2.51, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-7,8,9,10-tetrahydrobenzo[h]chromen-4-one is sourced from PubChem (CID 11737711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).