[4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine

C15H16F2N2O2 — CID 139543711

IUPAC[4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine
SMILESCc1cc(OC(F)F)c(CN)c(OCc2ccccc2)n1
InChIInChI=1S/C15H16F2N2O2/c1-10-7-13(21-15(16)17)12(8-18)14(19-10)20-9-11-5-3-2-4-6-11/h2-7,15H,8-9,18H2,1H3
InChIKeyYTNVRKXFIQFFOQ-UHFFFAOYSA-N
MW294.30 g/mol
LogP3.03
Rot. Bonds6

About [4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine

[4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine (PubChem CID 139543711) has the molecular formula C15H16F2N2O2 and a molecular weight of 294.30 g/mol. Its IUPAC name is [4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine
PubChem CID139543711
Molecular FormulaC15H16F2N2O2
Molecular Weight294.30 g/mol
Exact Mass294.12
IUPAC Name[4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine
SMILESCc1cc(OC(F)F)c(CN)c(OCc2ccccc2)n1
InChIInChI=1S/C15H16F2N2O2/c1-10-7-13(21-15(16)17)12(8-18)14(19-10)20-9-11-5-3-2-4-6-11/h2-7,15H,8-9,18H2,1H3
InChIKeyYTNVRKXFIQFFOQ-UHFFFAOYSA-N
XLogP3.03
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.30
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(6-methyl-2-phenylmethoxy-4-propan-2-yloxy-3-pyridinyl)methyl methanesulfonate
CID 121440121
5-(difluoromethoxy)-2,4-bis(phenylmethoxy)pyrimidine
CID 167327400
7-bromo-5,8-dichloro-2-[[4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methyl]-3,4-dihydroisoquinolin-1-one
CID 118572060
(4-butan-2-yloxy-6-methyl-2-phenylmethoxy-3-pyridinyl)methyl methanesulfinate
CID 126599269
8-chloro-7-(difluoromethoxy)-2-[(4,6-dimethyl-2-phenylmethoxy-3-pyridinyl)methyl]-3,4-dihydroisoquinolin-1-one
CID 86723705
N-[(4,6-dimethyl-2-phenylmethoxy-3-pyridinyl)methyl]propan-2-amine
CID 62291538
3-ethyl-2-fluoro-6-methyl-4-phenylmethoxypyridine
CID 166726090
(3-amino-6-methyl-2-phenylmethoxy-4-pyridinyl)methanol
CID 139508361
6-methyl-3-nitro-2-phenylmethoxypyridin-4-amine
CID 140911567
(6-methyl-3-phenylmethoxy-2-pyridinyl)methanamine
CID 58869463
N'-hydroxy-4,6-dimethyl-2-phenylmethoxypyridine-3-carboximidamide
CID 61177131
1-(4,6-dimethyl-2-phenylmethoxy-3-pyridinyl)ethanone
CID 118546342

Frequently Asked Questions

What is the IUPAC name of [4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine?
The IUPAC name of [4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine (CID 139543711) is [4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine.
What is the SMILES notation for [4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine?
The canonical SMILES for [4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine is Cc1cc(OC(F)F)c(CN)c(OCc2ccccc2)n1.
What is the InChIKey of [4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine?
The InChIKey is YTNVRKXFIQFFOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2N2O2/c1-10-7-13(21-15(16)17)12(8-18)14(19-10)20-9-11-5-3-2-4-6-11/h2-7,15H,8-9,18H2,1H3.
What are the key properties of [4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine?
[4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine has a molecular weight of 294.30 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(difluoromethoxy)-6-methyl-2-phenylmethoxy-3-pyridinyl]methanamine is sourced from PubChem (CID 139543711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).