8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline

C14H19NO2 — CID 105493234

IUPAC8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline
SMILESCOc1cccc2c1NCCC2C1CCOC1
InChIInChI=1S/C14H19NO2/c1-16-13-4-2-3-12-11(5-7-15-14(12)13)10-6-8-17-9-10/h2-4,10-11,15H,5-9H2,1H3
InChIKeyVLDOFHNBAGUULY-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.63
Rot. Bonds2

About 8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline

8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline (PubChem CID 105493234) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline
PubChem CID105493234
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline
SMILESCOc1cccc2c1NCCC2C1CCOC1
InChIInChI=1S/C14H19NO2/c1-16-13-4-2-3-12-11(5-7-15-14(12)13)10-6-8-17-9-10/h2-4,10-11,15H,5-9H2,1H3
InChIKeyVLDOFHNBAGUULY-UHFFFAOYSA-N
XLogP2.63
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline
CID 54763699
4-(2-methoxyphenyl)oxane
CID 121009799
4-methoxy-1,1a,3,7b-tetrahydrocyclopropa[c]quinolin-2-one
CID 169499137
4-methoxy-5,5a,6,7,8,9,10,10a-octahydrocyclohepta[b]indole
CID 84683089
8-methoxy-N,N,3-trimethyl-1,2,3,4-tetrahydroquinolin-4-amine
CID 82275705
2,4,4a,5,6,10b-hexahydro-1H-pyrano[3,4-c][1,8]naphthyridine
CID 156787158
2-methyl-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline
CID 106778974
6-methoxy-2,3,4,5-tetrahydro-1,5-benzoxazepine
CID 114765120
7-methoxy-3-(3,3,5-trimethylcyclohexyl)-2,3-dihydro-1H-indole
CID 106986429
3-methoxy-2-[(3R)-morpholin-3-yl]phenol
CID 131502010
(3S)-3-(2-methoxyphenoxy)oxolane
CID 141103497
6-methoxy-2,2a,7,7a-tetrahydro-1H-cyclobuta[a]indene
CID 90201598

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline (CID 105493234) is 8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline is COc1cccc2c1NCCC2C1CCOC1.
What is the InChIKey of 8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline?
The InChIKey is VLDOFHNBAGUULY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-16-13-4-2-3-12-11(5-7-15-14(12)13)10-6-8-17-9-10/h2-4,10-11,15H,5-9H2,1H3.
What are the key properties of 8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline?
8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline has a molecular weight of 233.31 g/mol, XLogP of 2.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 105493234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).