2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol

C13H20N2O — CID 115733141

IUPAC2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol
SMILESOCCC1(CNCc2ccccn2)CCC1
InChIInChI=1S/C13H20N2O/c16-9-7-13(5-3-6-13)11-14-10-12-4-1-2-8-15-12/h1-2,4,8,14,16H,3,5-7,9-11H2
InChIKeyDNKFYSYMDXTHOG-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.72
Rot. Bonds6

About 2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol

2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol (PubChem CID 115733141) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol.

Molecular Properties

Compound Name2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol
PubChem CID115733141
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol
SMILESOCCC1(CNCc2ccccn2)CCC1
InChIInChI=1S/C13H20N2O/c16-9-7-13(5-3-6-13)11-14-10-12-4-1-2-8-15-12/h1-2,4,8,14,16H,3,5-7,9-11H2
InChIKeyDNKFYSYMDXTHOG-UHFFFAOYSA-N
XLogP1.72
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[(pyridin-2-ylmethylamino)methyl]cyclopentyl]methanol
CID 115358745
N-[(1-ethylcyclopropyl)methyl]-1-pyridin-2-ylmethanamine
CID 103735456
4-[(pyridin-2-ylmethylamino)methyl]piperidin-4-ol
CID 82286679
N-[[1-(aminomethyl)cyclobutyl]methyl]-2-pyridin-2-ylethanamine
CID 115245931
2-[1-[[(5-bromoquinolin-8-yl)methylamino]methyl]cyclopropyl]ethanol
CID 114750052
3-[(pyridin-2-ylmethylamino)methyl]thiolan-3-ol
CID 111629685
zinc;1-pyridin-2-yl-N-(pyridin-2-ylmethyl)methanamine;dihydrochloride
CID 73345757
2-[1-[(1,3-thiazol-5-ylmethylamino)methyl]cyclobutyl]ethanol
CID 115733110
3-[[[1-(2-hydroxyethyl)cyclopropyl]methylamino]methyl]benzene-1,2-diol
CID 114756017
2-[[[1-(2-hydroxyethyl)cyclopropyl]methylamino]methyl]benzonitrile
CID 104954545
2-(1-pyridin-2-ylcyclobutyl)ethanol
CID 83683269
N'-(pyridin-2-ylmethyl)-N-[2-(pyridin-2-ylmethylamino)ethyl]ethane-1,2-diamine
CID 12029921

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol?
The IUPAC name of 2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol (CID 115733141) is 2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol.
What is the SMILES notation for 2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol?
The canonical SMILES for 2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol is OCCC1(CNCc2ccccn2)CCC1.
What is the InChIKey of 2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol?
The InChIKey is DNKFYSYMDXTHOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c16-9-7-13(5-3-6-13)11-14-10-12-4-1-2-8-15-12/h1-2,4,8,14,16H,3,5-7,9-11H2.
What are the key properties of 2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol?
2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol has a molecular weight of 220.32 g/mol, XLogP of 1.72, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(pyridin-2-ylmethylamino)methyl]cyclobutyl]ethanol is sourced from PubChem (CID 115733141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).