[3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol

C13H19ClN2O2 — CID 61436346

IUPAC[3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol
SMILESCN(CC1CCCCO1)c1ccc(Cl)c(CO)n1
InChIInChI=1S/C13H19ClN2O2/c1-16(8-10-4-2-3-7-18-10)13-6-5-11(14)12(9-17)15-13/h5-6,10,17H,2-4,7-9H2,1H3
InChIKeyFRILORNRZFIKKW-UHFFFAOYSA-N
MW270.76 g/mol
LogP2.23
Rot. Bonds4

About [3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol

[3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol (PubChem CID 61436346) has the molecular formula C13H19ClN2O2 and a molecular weight of 270.76 g/mol. Its IUPAC name is [3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol
PubChem CID61436346
Molecular FormulaC13H19ClN2O2
Molecular Weight270.76 g/mol
Exact Mass270.11
IUPAC Name[3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol
SMILESCN(CC1CCCCO1)c1ccc(Cl)c(CO)n1
InChIInChI=1S/C13H19ClN2O2/c1-16(8-10-4-2-3-7-18-10)13-6-5-11(14)12(9-17)15-13/h5-6,10,17H,2-4,7-9H2,1H3
InChIKeyFRILORNRZFIKKW-UHFFFAOYSA-N
XLogP2.23
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-chloro-6-[ethyl(oxolan-2-ylmethyl)amino]-2-pyridinyl]methanol
CID 61435500
[3-chloro-6-[cyclohexylmethyl(methyl)amino]-2-pyridinyl]methanol
CID 54949040
5-chloro-6-[(cyclopropylamino)methyl]-N-methyl-N-(oxolan-2-ylmethyl)pyridin-2-amine
CID 62293193
5-chloro-N-methyl-N-(oxolan-2-ylmethyl)-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62293192
[3-chloro-6-[methyl(oxan-3-ylmethyl)amino]-2-pyridinyl]methanol
CID 63713496
5-bromo-N,6-dimethyl-N-(oxan-2-ylmethyl)pyridin-2-amine
CID 103915128
N-methyl-N-(oxan-2-ylmethyl)quinolin-2-amine
CID 133271800
6-chloro-N-methyl-N-(oxan-2-ylmethyl)pyrazin-2-amine
CID 61362605
[2-chloro-6-[methyl(oxan-2-ylmethyl)amino]phenyl]methanol
CID 61431905
2-[[5-chloro-6-(hydroxymethyl)-2-pyridinyl]-methylamino]cyclohexan-1-ol
CID 102636125
3-chloro-N-methyl-N-(oxan-2-ylmethyl)-1,2,4-triazin-5-amine
CID 115001102
[5-[methyl(oxolan-2-ylmethyl)amino]pyrazin-2-yl]methanol
CID 107372756

Frequently Asked Questions

What is the IUPAC name of [3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol?
The IUPAC name of [3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol (CID 61436346) is [3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol.
What is the SMILES notation for [3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol?
The canonical SMILES for [3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol is CN(CC1CCCCO1)c1ccc(Cl)c(CO)n1.
What is the InChIKey of [3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol?
The InChIKey is FRILORNRZFIKKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2O2/c1-16(8-10-4-2-3-7-18-10)13-6-5-11(14)12(9-17)15-13/h5-6,10,17H,2-4,7-9H2,1H3.
What are the key properties of [3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol?
[3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol has a molecular weight of 270.76 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-chloro-6-[methyl(oxan-2-ylmethyl)amino]-2-pyridinyl]methanol is sourced from PubChem (CID 61436346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).