3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol

C16H19NO — CID 105105790

IUPAC3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol
SMILESCc1cc(C(O)CCC2CC2)c2ccccc2n1
InChIInChI=1S/C16H19NO/c1-11-10-14(16(18)9-8-12-6-7-12)13-4-2-3-5-15(13)17-11/h2-5,10,12,16,18H,6-9H2,1H3
InChIKeySQJYRZZZNKNDSC-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.77
Rot. Bonds4

About 3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol

3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol (PubChem CID 105105790) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol.

Molecular Properties

Compound Name3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol
PubChem CID105105790
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol
SMILESCc1cc(C(O)CCC2CC2)c2ccccc2n1
InChIInChI=1S/C16H19NO/c1-11-10-14(16(18)9-8-12-6-7-12)13-4-2-3-5-15(13)17-11/h2-5,10,12,16,18H,6-9H2,1H3
InChIKeySQJYRZZZNKNDSC-UHFFFAOYSA-N
XLogP3.77
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Velnacrine
CID 3655
2-Quinolineethanol
CID 70532
9-Amino-1,2,3,4-tetrahydroacridin-4-ol
CID 179850
1-[2,8-Bis(trifluoromethyl)-4-quinolyl]-2-(propylamino)ethanol
CID 432290
1-Phenyl-1-(2-quinolinyl)ethanol
CID 273212
1-Acridinol, 1,2,3,4-tetrahydro-9-(methylamino)-
CID 3025632
2-Quinolinemethanol
CID 73196
4-(Hydroxymethyl)quinoline
CID 80479
2-Hydroxytacrine
CID 179849
1-[2,8-Bis(trifluoromethyl)-4-quinolyl]-2-(dipropylamino)ethanol
CID 432292
WR 184806
CID 173672
1,1,1-Trichloro-3-(quinolin-2-yl)propan-2-ol
CID 225990

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol?
The IUPAC name of 3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol (CID 105105790) is 3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol.
What is the SMILES notation for 3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol?
The canonical SMILES for 3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol is Cc1cc(C(O)CCC2CC2)c2ccccc2n1.
What is the InChIKey of 3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol?
The InChIKey is SQJYRZZZNKNDSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-11-10-14(16(18)9-8-12-6-7-12)13-4-2-3-5-15(13)17-11/h2-5,10,12,16,18H,6-9H2,1H3.
What are the key properties of 3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol?
3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol has a molecular weight of 241.33 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-1-(2-methylquinolin-4-yl)propan-1-ol is sourced from PubChem (CID 105105790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).