[1-(quinolin-6-ylmethylamino)cyclobutyl]methanol

C15H18N2O — CID 113263671

IUPAC[1-(quinolin-6-ylmethylamino)cyclobutyl]methanol
SMILESOCC1(NCc2ccc3ncccc3c2)CCC1
InChIInChI=1S/C15H18N2O/c18-11-15(6-2-7-15)17-10-12-4-5-14-13(9-12)3-1-8-16-14/h1,3-5,8-9,17-18H,2,6-7,10-11H2
InChIKeyRQNKGCPNEBVZGO-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.24
Rot. Bonds4

About [1-(quinolin-6-ylmethylamino)cyclobutyl]methanol

[1-(quinolin-6-ylmethylamino)cyclobutyl]methanol (PubChem CID 113263671) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is [1-(quinolin-6-ylmethylamino)cyclobutyl]methanol.

Molecular Properties

Compound Name[1-(quinolin-6-ylmethylamino)cyclobutyl]methanol
PubChem CID113263671
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name[1-(quinolin-6-ylmethylamino)cyclobutyl]methanol
SMILESOCC1(NCc2ccc3ncccc3c2)CCC1
InChIInChI=1S/C15H18N2O/c18-11-15(6-2-7-15)17-10-12-4-5-14-13(9-12)3-1-8-16-14/h1,3-5,8-9,17-18H,2,6-7,10-11H2
InChIKeyRQNKGCPNEBVZGO-UHFFFAOYSA-N
XLogP2.24
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-N-(quinolin-6-ylmethyl)cyclopropan-1-amine
CID 115635138
1-(chloromethyl)-3-methyl-N-(quinolin-6-ylmethyl)cyclohexan-1-amine
CID 65030473
2-(hydroxymethyl)-2-(quinolin-6-ylmethylamino)propane-1,3-diol
CID 107850850
N,N-dimethyl-1-[(quinolin-6-ylmethylamino)methyl]cyclobutan-1-amine
CID 105414996
1-(quinolin-6-ylmethyl)cyclopropane-1-carboxylic acid
CID 79425635
N-(quinolin-6-ylmethyl)prop-2-yn-1-amine
CID 28776188
2,2-dimethyl-N-(quinolin-6-ylmethyl)cyclopropan-1-amine
CID 61222294
1-ethyl-N-(naphthalen-2-ylmethyl)cyclobutan-1-amine
CID 113488696
[1-[(3-bromo-4-chlorophenyl)methylamino]cyclobutyl]methanol
CID 115909414
4-chloro-N-(quinolin-6-ylmethyl)butan-1-amine
CID 106844355
3-methyl-1-(quinolin-6-ylmethylamino)butan-2-ol
CID 115630613
1-(quinolin-6-ylmethoxymethyl)cyclopentan-1-amine
CID 64573735

Frequently Asked Questions

What is the IUPAC name of [1-(quinolin-6-ylmethylamino)cyclobutyl]methanol?
The IUPAC name of [1-(quinolin-6-ylmethylamino)cyclobutyl]methanol (CID 113263671) is [1-(quinolin-6-ylmethylamino)cyclobutyl]methanol.
What is the SMILES notation for [1-(quinolin-6-ylmethylamino)cyclobutyl]methanol?
The canonical SMILES for [1-(quinolin-6-ylmethylamino)cyclobutyl]methanol is OCC1(NCc2ccc3ncccc3c2)CCC1.
What is the InChIKey of [1-(quinolin-6-ylmethylamino)cyclobutyl]methanol?
The InChIKey is RQNKGCPNEBVZGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c18-11-15(6-2-7-15)17-10-12-4-5-14-13(9-12)3-1-8-16-14/h1,3-5,8-9,17-18H,2,6-7,10-11H2.
What are the key properties of [1-(quinolin-6-ylmethylamino)cyclobutyl]methanol?
[1-(quinolin-6-ylmethylamino)cyclobutyl]methanol has a molecular weight of 242.32 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(quinolin-6-ylmethylamino)cyclobutyl]methanol is sourced from PubChem (CID 113263671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).