2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone

C14H17NO2 — CID 576078

IUPAC2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone
SMILESO=C(C1Cc2ccccc2C1)N1CCOCC1
InChIInChI=1S/C14H17NO2/c16-14(15-5-7-17-8-6-15)13-9-11-3-1-2-4-12(11)10-13/h1-4,13H,5-10H2
InChIKeyKPFJLZTYQIYWHA-UHFFFAOYSA-N
MW231.29 g/mol
LogP1.26
Rot. Bonds1

About 2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone

2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone (PubChem CID 576078) has the molecular formula C14H17NO2 and a molecular weight of 231.29 g/mol. Its IUPAC name is 2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone
PubChem CID576078
Molecular FormulaC14H17NO2
Molecular Weight231.29 g/mol
Exact Mass231.13
IUPAC Name2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone
SMILESO=C(C1Cc2ccccc2C1)N1CCOCC1
InChIInChI=1S/C14H17NO2/c16-14(15-5-7-17-8-6-15)13-9-11-3-1-2-4-12(11)10-13/h1-4,13H,5-10H2
InChIKeyKPFJLZTYQIYWHA-UHFFFAOYSA-N
XLogP1.26
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.29
LogP ≤ 51.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone?
The IUPAC name of 2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone (CID 576078) is 2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone.
What is the SMILES notation for 2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone?
The canonical SMILES for 2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone is O=C(C1Cc2ccccc2C1)N1CCOCC1.
What is the InChIKey of 2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone?
The InChIKey is KPFJLZTYQIYWHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2/c16-14(15-5-7-17-8-6-15)13-9-11-3-1-2-4-12(11)10-13/h1-4,13H,5-10H2.
What are the key properties of 2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone?
2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone has a molecular weight of 231.29 g/mol, XLogP of 1.26, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-inden-2-yl(morpholin-4-yl)methanone is sourced from PubChem (CID 576078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).