[1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol

C15H17NO — CID 116997477

IUPAC[1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol
SMILESCc1cnc2ccc(CC3(CO)CC3)cc2c1
InChIInChI=1S/C15H17NO/c1-11-6-13-7-12(2-3-14(13)16-9-11)8-15(10-17)4-5-15/h2-3,6-7,9,17H,4-5,8,10H2,1H3
InChIKeyPUXGPFNPWNVNHH-UHFFFAOYSA-N
MW227.31 g/mol
LogP2.86
Rot. Bonds3

About [1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol

[1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol (PubChem CID 116997477) has the molecular formula C15H17NO and a molecular weight of 227.31 g/mol. Its IUPAC name is [1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol
PubChem CID116997477
Molecular FormulaC15H17NO
Molecular Weight227.31 g/mol
Exact Mass227.13
IUPAC Name[1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol
SMILESCc1cnc2ccc(CC3(CO)CC3)cc2c1
InChIInChI=1S/C15H17NO/c1-11-6-13-7-12(2-3-14(13)16-9-11)8-15(10-17)4-5-15/h2-3,6-7,9,17H,4-5,8,10H2,1H3
InChIKeyPUXGPFNPWNVNHH-UHFFFAOYSA-N
XLogP2.86
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-[(3-methylquinolin-6-yl)methyl]cyclobutyl]methanol
CID 116997484
[1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanamine
CID 116997478
1-[(3-methylquinolin-6-yl)methyl]cyclobutane-1-carbonitrile
CID 116997480
3-(3-methylquinolin-6-yl)propanoic acid
CID 83886586
6-(2-chloroethyl)-3-methylquinoline
CID 116997430
2-methyl-4-(3-methylquinolin-6-yl)butan-2-ol
CID 177184332
1-(3-methylquinolin-6-yl)propan-2-amine
CID 83880771
methane;methyl 3-methylquinoline-6-carboxylate;(3-methylquinolin-6-yl)methanol
CID 158164435
N-[(3-methylquinolin-6-yl)methyl]cyclopropanamine
CID 116997781
3-methyl-6-(piperidin-4-ylmethyl)quinoline
CID 116997415
4-(3-methylquinolin-6-yl)butan-2-amine
CID 116997396
N-ethyl-2-(3-methylquinolin-6-yl)ethanamine
CID 116997407

Frequently Asked Questions

What is the IUPAC name of [1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol?
The IUPAC name of [1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol (CID 116997477) is [1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol is Cc1cnc2ccc(CC3(CO)CC3)cc2c1.
What is the InChIKey of [1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol?
The InChIKey is PUXGPFNPWNVNHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO/c1-11-6-13-7-12(2-3-14(13)16-9-11)8-15(10-17)4-5-15/h2-3,6-7,9,17H,4-5,8,10H2,1H3.
What are the key properties of [1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol?
[1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol has a molecular weight of 227.31 g/mol, XLogP of 2.86, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(3-methylquinolin-6-yl)methyl]cyclopropyl]methanol is sourced from PubChem (CID 116997477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).