(3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol

C14H16N2O2 — CID 139508361

IUPAC(3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol
SMILESCc1cc(CO)c(N)c(OCc2ccccc2)n1
InChIInChI=1S/C14H16N2O2/c1-10-7-12(8-17)13(15)14(16-10)18-9-11-5-3-2-4-6-11/h2-7,17H,8-9,15H2,1H3
InChIKeyBZFSGOWFRDHFGM-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.04
Rot. Bonds4

About (3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol

(3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol (PubChem CID 139508361) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is (3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol.

Molecular Properties

Compound Name(3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol
PubChem CID139508361
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name(3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol
SMILESCc1cc(CO)c(N)c(OCc2ccccc2)n1
InChIInChI=1S/C14H16N2O2/c1-10-7-12(8-17)13(15)14(16-10)18-9-11-5-3-2-4-6-11/h2-7,17H,8-9,15H2,1H3
InChIKeyBZFSGOWFRDHFGM-UHFFFAOYSA-N
XLogP2.04
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol?
The IUPAC name of (3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol (CID 139508361) is (3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol.
What is the SMILES notation for (3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol?
The canonical SMILES for (3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol is Cc1cc(CO)c(N)c(OCc2ccccc2)n1.
What is the InChIKey of (3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol?
The InChIKey is BZFSGOWFRDHFGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-10-7-12(8-17)13(15)14(16-10)18-9-11-5-3-2-4-6-11/h2-7,17H,8-9,15H2,1H3.
What are the key properties of (3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol?
(3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol has a molecular weight of 244.29 g/mol, XLogP of 2.04, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol is sourced from PubChem (CID 139508361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).