4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine

C19H24N2O2 — CID 86803644

IUPAC4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine
SMILESCn1cccc1C1COCCN1CCc1ccc2c(c1)CCO2
InChIInChI=1S/C19H24N2O2/c1-20-8-2-3-17(20)18-14-22-12-10-21(18)9-6-15-4-5-19-16(13-15)7-11-23-19/h2-5,8,13,18H,6-7,9-12,14H2,1H3
InChIKeySLXMXDZVCPBDFX-UHFFFAOYSA-N
MW312.41 g/mol
LogP2.58
Rot. Bonds4

About 4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine

4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine (PubChem CID 86803644) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine.

Molecular Properties

Compound Name4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine
PubChem CID86803644
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine
SMILESCn1cccc1C1COCCN1CCc1ccc2c(c1)CCO2
InChIInChI=1S/C19H24N2O2/c1-20-8-2-3-17(20)18-14-22-12-10-21(18)9-6-15-4-5-19-16(13-15)7-11-23-19/h2-5,8,13,18H,6-7,9-12,14H2,1H3
InChIKeySLXMXDZVCPBDFX-UHFFFAOYSA-N
XLogP2.58
TPSA26.63 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]morpholine-3-carboxylate
CID 115670642
cis-(1R,2R)-2-[(3S)-4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]morpholin-3-yl]cyclopentan-1-ol
CID 129351561
(3S)-3-[2-[(3S)-3-(1-methylpyrrol-2-yl)morpholin-4-yl]ethyl]oxolan-2-one
CID 129430025
(3R)-4-(cyclobutylmethyl)-3-(1-methylpyrrol-2-yl)morpholine
CID 99631897
[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-4-methylpiperazin-2-yl]methanamine
CID 80506838
(3R)-1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-3-ol
CID 46220656
3-cyclopropyl-1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidine
CID 154807715
1-[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidin-2-yl]-N-methylmethanamine
CID 65444676
4-chloro-1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperidine
CID 65445385
N-[[1-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]pyrrolidin-2-yl]methyl]propan-2-amine
CID 65446001
N-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-1-methylpiperidin-4-amine
CID 65431601
1-[4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]piperazin-1-yl]ethanone
CID 163350132

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine?
The IUPAC name of 4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine (CID 86803644) is 4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine.
What is the SMILES notation for 4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine?
The canonical SMILES for 4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine is Cn1cccc1C1COCCN1CCc1ccc2c(c1)CCO2.
What is the InChIKey of 4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine?
The InChIKey is SLXMXDZVCPBDFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-20-8-2-3-17(20)18-14-22-12-10-21(18)9-6-15-4-5-19-16(13-15)7-11-23-19/h2-5,8,13,18H,6-7,9-12,14H2,1H3.
What are the key properties of 4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine?
4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine has a molecular weight of 312.41 g/mol, XLogP of 2.58, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-(1-methylpyrrol-2-yl)morpholine is sourced from PubChem (CID 86803644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).