8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline

C18H23N3 — CID 114722102

IUPAC8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline
SMILESCC(Cn1cncc1-c1cccc2c1NCCC2)C1CC1
InChIInChI=1S/C18H23N3/c1-13(14-7-8-14)11-21-12-19-10-17(21)16-6-2-4-15-5-3-9-20-18(15)16/h2,4,6,10,12-14,20H,3,5,7-9,11H2,1H3
InChIKeyJDCUYZPETSKXJH-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.95
Rot. Bonds4

About 8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline

8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline (PubChem CID 114722102) has the molecular formula C18H23N3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline
PubChem CID114722102
Molecular FormulaC18H23N3
Molecular Weight281.40 g/mol
Exact Mass281.19
IUPAC Name8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline
SMILESCC(Cn1cncc1-c1cccc2c1NCCC2)C1CC1
InChIInChI=1S/C18H23N3/c1-13(14-7-8-14)11-21-12-19-10-17(21)16-6-2-4-15-5-3-9-20-18(15)16/h2,4,6,10,12-14,20H,3,5,7-9,11H2,1H3
InChIKeyJDCUYZPETSKXJH-UHFFFAOYSA-N
XLogP3.95
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8-(3-pentan-2-ylimidazol-4-yl)-1,2,3,4-tetrahydroquinoline
CID 114716664
3-[5-(1,2,3,4-tetrahydroquinolin-8-yl)imidazol-1-yl]propan-1-amine
CID 114718280
8-[3-(2-methoxy-2-methylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline
CID 114722364
N-methyl-2-[5-(1,2,3,4-tetrahydroquinolin-8-yl)imidazol-1-yl]acetamide
CID 114715972
7-[3-(cyclopropylmethyl)imidazol-4-yl]-2,3-dihydro-1H-indole
CID 114717398
5-[[5-(1,2,3,4-tetrahydroquinolin-8-yl)imidazol-1-yl]methyl]-1,2-oxazole
CID 106422528
8-[3-(2-methylbutan-2-yl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline
CID 114717316
7-(3-benzylimidazol-4-yl)-2,3-dihydro-1H-indole
CID 114716253
8-[3-(1-methoxy-2-methylpropan-2-yl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline
CID 114722090
3-[5-(2,3-dihydro-1H-indol-7-yl)imidazol-1-yl]-N-methylpropanamide
CID 114719194
7-(3-cyclobutylimidazol-4-yl)-2,3-dihydro-1H-indole
CID 114720083
7-[3-(4-methoxybutan-2-yl)imidazol-4-yl]-2,3-dihydro-1H-indole
CID 114721013

Frequently Asked Questions

What is the IUPAC name of 8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline (CID 114722102) is 8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline is CC(Cn1cncc1-c1cccc2c1NCCC2)C1CC1.
What is the InChIKey of 8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline?
The InChIKey is JDCUYZPETSKXJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3/c1-13(14-7-8-14)11-21-12-19-10-17(21)16-6-2-4-15-5-3-9-20-18(15)16/h2,4,6,10,12-14,20H,3,5,7-9,11H2,1H3.
What are the key properties of 8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline?
8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline has a molecular weight of 281.40 g/mol, XLogP of 3.95, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[3-(2-cyclopropylpropyl)imidazol-4-yl]-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 114722102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).