2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline

C17H23N3 — CID 79761911

IUPAC2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline
SMILESCCCn1ccnc1CCC1CCc2ccccc2N1
InChIInChI=1S/C17H23N3/c1-2-12-20-13-11-18-17(20)10-9-15-8-7-14-5-3-4-6-16(14)19-15/h3-6,11,13,15,19H,2,7-10,12H2,1H3
InChIKeyWORJXCGJILUVLY-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.65
Rot. Bonds5

About 2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline

2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline (PubChem CID 79761911) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline
PubChem CID79761911
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline
SMILESCCCn1ccnc1CCC1CCc2ccccc2N1
InChIInChI=1S/C17H23N3/c1-2-12-20-13-11-18-17(20)10-9-15-8-7-14-5-3-4-6-16(14)19-15/h3-6,11,13,15,19H,2,7-10,12H2,1H3
InChIKeyWORJXCGJILUVLY-UHFFFAOYSA-N
XLogP3.65
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1-ethylimidazol-2-yl)methyl]-1,2,3,4-tetrahydroquinoline
CID 64955897
1-(2,3-dihydro-1H-inden-1-yl)-2-(1-propylimidazol-2-yl)ethanone
CID 79744199
2-[(4-chloro-1-propylpyrazol-5-yl)methyl]-1,2,3,4-tetrahydroquinoline
CID 114662301
8-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline
CID 79761548
2-(3-bromobutyl)-1-propylimidazole
CID 64508695
(1-propylimidazol-2-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methanol
CID 63975228
2-[(1-ethylimidazol-2-yl)methyl]-3-methyl-1,2,3,4-tetrahydroquinoline
CID 106780430
2-(3,3,3-trifluoropropyl)-1,2,3,4-tetrahydroquinoline
CID 106779766
2-[(4-chloro-1-ethylpyrazol-5-yl)methyl]-1,2,3,4-tetrahydroquinoline
CID 114662296
1-phenyl-4-(1-propylimidazol-2-yl)butan-1-ol
CID 79761213
2-(4-chloro-4-cyclopropylbutyl)-1-propylimidazole
CID 79760428
3-[2-(1-propylimidazol-2-yl)ethyl]pyridin-2-amine
CID 79761561

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline (CID 79761911) is 2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline is CCCn1ccnc1CCC1CCc2ccccc2N1.
What is the InChIKey of 2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline?
The InChIKey is WORJXCGJILUVLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-2-12-20-13-11-18-17(20)10-9-15-8-7-14-5-3-4-6-16(14)19-15/h3-6,11,13,15,19H,2,7-10,12H2,1H3.
What are the key properties of 2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline?
2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline has a molecular weight of 269.39 g/mol, XLogP of 3.65, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-propylimidazol-2-yl)ethyl]-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 79761911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).