4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine

C18H30N2O — CID 170871449

IUPAC4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine
SMILESCc1cc(CCCN2CCOCC2)c(C)n1C1CCCC1
InChIInChI=1S/C18H30N2O/c1-15-14-17(6-5-9-19-10-12-21-13-11-19)16(2)20(15)18-7-3-4-8-18/h14,18H,3-13H2,1-2H3
InChIKeyCKGFMOCPZHKAMY-UHFFFAOYSA-N
MW290.45 g/mol
LogP3.48
Rot. Bonds5

About 4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine

4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine (PubChem CID 170871449) has the molecular formula C18H30N2O and a molecular weight of 290.45 g/mol. Its IUPAC name is 4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine.

Molecular Properties

Compound Name4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine
PubChem CID170871449
Molecular FormulaC18H30N2O
Molecular Weight290.45 g/mol
Exact Mass290.24
IUPAC Name4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine
SMILESCc1cc(CCCN2CCOCC2)c(C)n1C1CCCC1
InChIInChI=1S/C18H30N2O/c1-15-14-17(6-5-9-19-10-12-21-13-11-19)16(2)20(15)18-7-3-4-8-18/h14,18H,3-13H2,1-2H3
InChIKeyCKGFMOCPZHKAMY-UHFFFAOYSA-N
XLogP3.48
TPSA17.40 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(1-cyclopropyl-2,5-dimethylpyrrol-3-yl)propyl]piperazine
CID 96678020
4-[3-[3-(3-morpholin-4-ylpropyl)naphthalen-2-yl]propyl]morpholine
CID 170869299
3-cyclohexyl-6-hydroxy-1-(3-morpholin-4-ylpropyl)pyrimidine-2,4-dione
CID 91574985
4-[3-[3,5-bis(3-morpholin-4-ylpropyl)phenyl]propyl]morpholine
CID 170870147
4-[3-(4-bromo-2-methylphenyl)propyl]morpholine
CID 170870052
1-cyclohexyl-N-[4-fluoro-3-(3-morpholin-4-ylpropanoylamino)phenyl]-2,5-dimethylpyrrole-3-carboxamide
CID 60554945
5-methyl-4-(3-morpholin-4-ylpropyl)benzene-1,3-diol
CID 170869328
4-[3-(4-methylthiophen-2-yl)propyl]morpholine
CID 170871201
4-[3-(4,5-dimethylfuran-2-yl)propyl]morpholine
CID 170871309
4-[3-(2-cyclopentyloxy-3-methoxyphenyl)propyl]morpholine
CID 170870157
N,N-diethyl-3-methyl-4-(3-morpholin-4-ylpropyl)aniline
CID 170870635
7-methyl-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one
CID 170870829

Frequently Asked Questions

What is the IUPAC name of 4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine?
The IUPAC name of 4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine (CID 170871449) is 4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine.
What is the SMILES notation for 4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine?
The canonical SMILES for 4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine is Cc1cc(CCCN2CCOCC2)c(C)n1C1CCCC1.
What is the InChIKey of 4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine?
The InChIKey is CKGFMOCPZHKAMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O/c1-15-14-17(6-5-9-19-10-12-21-13-11-19)16(2)20(15)18-7-3-4-8-18/h14,18H,3-13H2,1-2H3.
What are the key properties of 4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine?
4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine has a molecular weight of 290.45 g/mol, XLogP of 3.48, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(1-cyclopentyl-2,5-dimethylpyrrol-3-yl)propyl]morpholine is sourced from PubChem (CID 170871449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).