[2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol

C12H14N2O2 — CID 61255618

IUPAC[2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol
SMILESCN(Cc1ccco1)c1ncccc1CO
InChIInChI=1S/C12H14N2O2/c1-14(8-11-5-3-7-16-11)12-10(9-15)4-2-6-13-12/h2-7,15H,8-9H2,1H3
InChIKeyFUMCTMKXEPZJJJ-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.80
Rot. Bonds4

About [2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol

[2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol (PubChem CID 61255618) has the molecular formula C12H14N2O2 and a molecular weight of 218.26 g/mol. Its IUPAC name is [2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol
PubChem CID61255618
Molecular FormulaC12H14N2O2
Molecular Weight218.26 g/mol
Exact Mass218.11
IUPAC Name[2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol
SMILESCN(Cc1ccco1)c1ncccc1CO
InChIInChI=1S/C12H14N2O2/c1-14(8-11-5-3-7-16-11)12-10(9-15)4-2-6-13-12/h2-7,15H,8-9H2,1H3
InChIKeyFUMCTMKXEPZJJJ-UHFFFAOYSA-N
XLogP1.80
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol?
The IUPAC name of [2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol (CID 61255618) is [2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol.
What is the SMILES notation for [2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol?
The canonical SMILES for [2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol is CN(Cc1ccco1)c1ncccc1CO.
What is the InChIKey of [2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol?
The InChIKey is FUMCTMKXEPZJJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O2/c1-14(8-11-5-3-7-16-11)12-10(9-15)4-2-6-13-12/h2-7,15H,8-9H2,1H3.
What are the key properties of [2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol?
[2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol has a molecular weight of 218.26 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[furan-2-ylmethyl(methyl)amino]-3-pyridinyl]methanol is sourced from PubChem (CID 61255618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).