2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol

C13H20N2O2 — CID 102676529

IUPAC2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol
SMILESCOc1cccc(CN(CCO)C2CCC2)n1
InChIInChI=1S/C13H20N2O2/c1-17-13-7-2-4-11(14-13)10-15(8-9-16)12-5-3-6-12/h2,4,7,12,16H,3,5-6,8-10H2,1H3
InChIKeyMWSDDMBWDLYVAX-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.44
Rot. Bonds6

About 2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol

2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol (PubChem CID 102676529) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol.

Molecular Properties

Compound Name2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol
PubChem CID102676529
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol
SMILESCOc1cccc(CN(CCO)C2CCC2)n1
InChIInChI=1S/C13H20N2O2/c1-17-13-7-2-4-11(14-13)10-15(8-9-16)12-5-3-6-12/h2,4,7,12,16H,3,5-6,8-10H2,1H3
InChIKeyMWSDDMBWDLYVAX-UHFFFAOYSA-N
XLogP1.44
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[cyclobutyl-[(6-methoxypyridazin-3-yl)methyl]amino]ethanol
CID 114268820
N'-cyclopropyl-N'-[(6-methoxy-2-pyridinyl)methyl]propane-1,3-diamine
CID 63992933
3-[cyclobutyl-[(6-methyl-2-pyridinyl)methyl]amino]propan-1-ol
CID 102848805
N-[(6-methoxy-2-pyridinyl)methyl]-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 63985516
2-[(6-methoxy-2-pyridinyl)methyl-(2,2,2-trifluoroethyl)amino]ethanol
CID 103864888
6-[[cyclobutyl(2-hydroxyethyl)amino]methyl]pyridine-2-carbohydrazide
CID 106909404
2-[cyclopentyl-[(4-methoxyphenyl)methyl]amino]ethanol
CID 62015643
2-[cyclobutyl(naphthalen-1-ylmethyl)amino]ethanol
CID 102677069
N-[[6-(aminomethyl)-2-pyridinyl]methyl]-N-(2-methoxyethyl)cyclopropanamine
CID 106906242
2-[cyclopentyl-[(1-methylpyrazol-3-yl)methyl]amino]ethanol
CID 82878038
N-(2-chloroethyl)-N-[(6-methoxy-2-pyridinyl)methyl]propan-1-amine
CID 63985137
N-(2-chloroethyl)-N-[(6-methyl-2-pyridinyl)methyl]cyclopropanamine
CID 79260720

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol?
The IUPAC name of 2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol (CID 102676529) is 2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol.
What is the SMILES notation for 2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol?
The canonical SMILES for 2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol is COc1cccc(CN(CCO)C2CCC2)n1.
What is the InChIKey of 2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol?
The InChIKey is MWSDDMBWDLYVAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-17-13-7-2-4-11(14-13)10-15(8-9-16)12-5-3-6-12/h2,4,7,12,16H,3,5-6,8-10H2,1H3.
What are the key properties of 2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol?
2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol has a molecular weight of 236.31 g/mol, XLogP of 1.44, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutyl-[(6-methoxy-2-pyridinyl)methyl]amino]ethanol is sourced from PubChem (CID 102676529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).