1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol

C17H22N2O — CID 115758417

IUPAC1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol
SMILESCN(Cc1ccc2ccccc2n1)CC1(O)CCCC1
InChIInChI=1S/C17H22N2O/c1-19(13-17(20)10-4-5-11-17)12-15-9-8-14-6-2-3-7-16(14)18-15/h2-3,6-9,20H,4-5,10-13H2,1H3
InChIKeyHTXHQQYTIKKVMQ-UHFFFAOYSA-N
MW270.38 g/mol
LogP2.97
Rot. Bonds4

About 1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol

1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol (PubChem CID 115758417) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol
PubChem CID115758417
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol
SMILESCN(Cc1ccc2ccccc2n1)CC1(O)CCCC1
InChIInChI=1S/C17H22N2O/c1-19(13-17(20)10-4-5-11-17)12-15-9-8-14-6-2-3-7-16(14)18-15/h2-3,6-9,20H,4-5,10-13H2,1H3
InChIKeyHTXHQQYTIKKVMQ-UHFFFAOYSA-N
XLogP2.97
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-[[5-[[methyl(quinolin-2-ylmethyl)amino]methyl]pyrazin-2-yl]methyl]-1-quinolin-2-ylmethanamine
CID 74539424
N-methyl-N-(quinolin-2-ylmethyl)propan-1-amine
CID 138692452
2-methyl-1-[methyl(quinolin-2-ylmethyl)amino]propan-2-ol
CID 78995605
1-[[(6-chloropyridazin-3-yl)methyl-methylamino]methyl]cyclopentan-1-ol
CID 114948795
N-methyl-N-[[4-(5-methyl-2-pyridinyl)piperidin-4-yl]methyl]-1-quinolin-2-ylmethanamine
CID 50980716
1-[[methyl-[(5-phenyl-1,2-oxazol-3-yl)methyl]amino]methyl]cyclopentan-1-ol
CID 114952613
4-N-methyl-4-N-(quinolin-2-ylmethyl)cyclohexane-1,4-diamine
CID 79112911
N'-hydroxy-3-[methyl(quinolin-2-ylmethyl)amino]propanimidamide
CID 43209629
4-[[(6-chloro-2-pyridinyl)methyl-methylamino]methyl]oxan-4-ol
CID 114948813
N-propan-2-yl-N-(quinolin-2-ylmethyl)propan-2-amine
CID 20687195
2-bromo-N-methyl-N-(quinolin-2-ylmethyl)cyclohexan-1-amine
CID 102637233
1-[[[2-(hydroxymethyl)quinolin-4-yl]-methylamino]methyl]cyclopentan-1-ol
CID 114952352

Frequently Asked Questions

What is the IUPAC name of 1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol (CID 115758417) is 1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol is CN(Cc1ccc2ccccc2n1)CC1(O)CCCC1.
What is the InChIKey of 1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol?
The InChIKey is HTXHQQYTIKKVMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-19(13-17(20)10-4-5-11-17)12-15-9-8-14-6-2-3-7-16(14)18-15/h2-3,6-9,20H,4-5,10-13H2,1H3.
What are the key properties of 1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol?
1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol has a molecular weight of 270.38 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[methyl(quinolin-2-ylmethyl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 115758417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).