[5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone

C21H26N2O3 — CID 95195380

IUPAC[5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone
SMILESC[C@H](c1ccc(-c2ccc(C(=O)N3CCCC3)o2)cc1)N1CCOCC1
InChIInChI=1S/C21H26N2O3/c1-16(22-12-14-25-15-13-22)17-4-6-18(7-5-17)19-8-9-20(26-19)21(24)23-10-2-3-11-23/h4-9,16H,2-3,10-15H2,1H3/t16-/m1/s1
InChIKeyNIXYDGUHLCKWBI-MRXNPFEDSA-N
MW354.45 g/mol
LogP3.58
Rot. Bonds4

About [5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone

[5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone (PubChem CID 95195380) has the molecular formula C21H26N2O3 and a molecular weight of 354.45 g/mol. Its IUPAC name is [5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone
PubChem CID95195380
Molecular FormulaC21H26N2O3
Molecular Weight354.45 g/mol
Exact Mass354.19
IUPAC Name[5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone
SMILESC[C@H](c1ccc(-c2ccc(C(=O)N3CCCC3)o2)cc1)N1CCOCC1
InChIInChI=1S/C21H26N2O3/c1-16(22-12-14-25-15-13-22)17-4-6-18(7-5-17)19-8-9-20(26-19)21(24)23-10-2-3-11-23/h4-9,16H,2-3,10-15H2,1H3/t16-/m1/s1
InChIKeyNIXYDGUHLCKWBI-MRXNPFEDSA-N
XLogP3.58
TPSA45.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone with MolForge

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Related Compounds

[5-(4-methoxyphenyl)furan-2-yl]-pyrrolidin-1-ylmethanone
CID 53015377
[5-(4-fluorophenyl)furan-2-yl]-morpholin-4-ylmethanone
CID 4307207
[5-(4-aminophenyl)furan-2-yl]-piperidin-1-ylmethanone
CID 70036380
[5-[5-(pyrrolidine-1-carbonyl)furan-2-yl]furan-2-yl]-pyrrolidin-1-ylmethanone
CID 134697428
[5-(morpholine-4-carbonyl)furan-2-yl]-morpholin-4-ylmethanone
CID 165349427
1,4-diazepan-1-yl-[5-(4-fluorophenyl)furan-2-yl]methanone
CID 94296837
6-[4-(1-morpholin-4-ylethyl)phenyl]pyridazine-3-carboxylic acid
CID 122563480
[5-(3-ethylsulfanylphenyl)furan-2-yl]-morpholin-4-ylmethanone
CID 72909845
[5-(4-fluorophenyl)furan-2-yl]-[4-(1-hydroxyethyl)piperidin-1-yl]methanone
CID 111429882
[1-[5-(4-fluorophenyl)furan-2-carbonyl]piperidin-4-yl]-piperidin-1-ylmethanone
CID 51238675
4-[(1S)-1-[4-(4-methylsulfonylphenyl)phenyl]ethyl]morpholine
CID 126430266
(4-methylpiperazin-1-yl)-(5-phenylfuran-2-yl)methanone;hydrochloride
CID 163329487

Frequently Asked Questions

What is the IUPAC name of [5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone (CID 95195380) is [5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone is C[C@H](c1ccc(-c2ccc(C(=O)N3CCCC3)o2)cc1)N1CCOCC1.
What is the InChIKey of [5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone?
The InChIKey is NIXYDGUHLCKWBI-MRXNPFEDSA-N. The full InChI is InChI=1S/C21H26N2O3/c1-16(22-12-14-25-15-13-22)17-4-6-18(7-5-17)19-8-9-20(26-19)21(24)23-10-2-3-11-23/h4-9,16H,2-3,10-15H2,1H3/t16-/m1/s1.
What are the key properties of [5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone?
[5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone has a molecular weight of 354.45 g/mol, XLogP of 3.58, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[4-[(1R)-1-morpholin-4-ylethyl]phenyl]furan-2-yl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 95195380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).