2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one

C21H28N2O2 — CID 175483134

IUPAC2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one
SMILESCCC1Cc2c(c3ccccc3n2CC)C(=O)C1CN1CCOCC1
InChIInChI=1S/C21H28N2O2/c1-3-15-13-19-20(16-7-5-6-8-18(16)23(19)4-2)21(24)17(15)14-22-9-11-25-12-10-22/h5-8,15,17H,3-4,9-14H2,1-2H3
InChIKeyHGFHWKYEXZMZCI-UHFFFAOYSA-N
MW340.47 g/mol
LogP3.37
Rot. Bonds4

About 2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one

2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one (PubChem CID 175483134) has the molecular formula C21H28N2O2 and a molecular weight of 340.47 g/mol. Its IUPAC name is 2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one.

Molecular Properties

Compound Name2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one
PubChem CID175483134
Molecular FormulaC21H28N2O2
Molecular Weight340.47 g/mol
Exact Mass340.22
IUPAC Name2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one
SMILESCCC1Cc2c(c3ccccc3n2CC)C(=O)C1CN1CCOCC1
InChIInChI=1S/C21H28N2O2/c1-3-15-13-19-20(16-7-5-6-8-18(16)23(19)4-2)21(24)17(15)14-22-9-11-25-12-10-22/h5-8,15,17H,3-4,9-14H2,1-2H3
InChIKeyHGFHWKYEXZMZCI-UHFFFAOYSA-N
XLogP3.37
TPSA34.47 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

9-ethyl-2-methyl-3-[[2-(trifluoromethyl)pyrrol-1-yl]methyl]-2,3-dihydro-1H-carbazol-4-one
CID 175483174
4-[3-(1-ethyl-2-methylindol-3-yl)propyl]morpholine
CID 170870957
3-butyl-1-(3-morpholin-4-ylpropyl)quinazoline-2,4-dione
CID 71495168
(9-ethylcarbazol-3-yl)-dimorpholin-4-yl-sulfanylidene-λ5-phosphane
CID 3581699
4-[(3-bromocarbazol-9-yl)methyl]morpholine
CID 23934226
(3R)-N-(9-ethylcarbazol-3-yl)-1-(2-morpholin-4-ylethyl)-5-oxopyrrolidine-3-carboxamide
CID 52909261
1-(2-morpholin-4-ylethyl)-4-prop-1-en-2-ylquinazolin-2-one
CID 142227752
1-(2-methylpropyl)-3-(2-morpholin-4-ylethyl)quinazoline-2,4-dione
CID 46223528
10-(2-morpholin-4-ylethyl)benzo[b][1,8]naphthyridin-5-one
CID 10267337
4-[2-(1-chloro-2-methyl-3,4-dihydro-1H-pyrido[4,3-b]indol-5-yl)ethyl]morpholine
CID 86634532
1-butyl-3-methyl-N-(2-morpholin-4-ylethyl)indole-2-carboxamide
CID 110497283
(1R,15S)-4-ethyl-4-azapentacyclo[13.2.1.02,14.03,11.05,10]octadeca-2(14),3(11),5,7,9,16-hexaene-12,13-dione
CID 11403529

Frequently Asked Questions

What is the IUPAC name of 2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one?
The IUPAC name of 2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one (CID 175483134) is 2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one.
What is the SMILES notation for 2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one?
The canonical SMILES for 2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one is CCC1Cc2c(c3ccccc3n2CC)C(=O)C1CN1CCOCC1.
What is the InChIKey of 2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one?
The InChIKey is HGFHWKYEXZMZCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O2/c1-3-15-13-19-20(16-7-5-6-8-18(16)23(19)4-2)21(24)17(15)14-22-9-11-25-12-10-22/h5-8,15,17H,3-4,9-14H2,1-2H3.
What are the key properties of 2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one?
2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one has a molecular weight of 340.47 g/mol, XLogP of 3.37, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,9-diethyl-3-(morpholin-4-ylmethyl)-2,3-dihydro-1H-carbazol-4-one is sourced from PubChem (CID 175483134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).