3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine

C19H20N6O2 — CID 170219787

IUPAC3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine
SMILESCn1cc(COC2C=CC(Cc3cc(-c4cccnc4N)on3)=CN2)cn1
InChIInChI=1S/C19H20N6O2/c1-25-11-14(10-23-25)12-26-18-5-4-13(9-22-18)7-15-8-17(27-24-15)16-3-2-6-21-19(16)20/h2-6,8-11,18,22H,7,12H2,1H3,(H2,20,21)
InChIKeyPGEAZTQRJNRATH-UHFFFAOYSA-N
MW364.41 g/mol
LogP2.18
Rot. Bonds6

About 3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine

3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine (PubChem CID 170219787) has the molecular formula C19H20N6O2 and a molecular weight of 364.41 g/mol. Its IUPAC name is 3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine.

Molecular Properties

Compound Name3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine
PubChem CID170219787
Molecular FormulaC19H20N6O2
Molecular Weight364.41 g/mol
Exact Mass364.16
IUPAC Name3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine
SMILESCn1cc(COC2C=CC(Cc3cc(-c4cccnc4N)on3)=CN2)cn1
InChIInChI=1S/C19H20N6O2/c1-25-11-14(10-23-25)12-26-18-5-4-13(9-22-18)7-15-8-17(27-24-15)16-3-2-6-21-19(16)20/h2-6,8-11,18,22H,7,12H2,1H3,(H2,20,21)
InChIKeyPGEAZTQRJNRATH-UHFFFAOYSA-N
XLogP2.18
TPSA104.02 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.41
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

3-[3-[[2-(1,3-oxazol-2-ylmethoxy)-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine
CID 170219798
3-[3-[[2-(3-fluorophenoxy)-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine
CID 170219950
3-[3-[[4-(phenoxymethyl)phenyl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine
CID 59255496
3-[3-[(4-phenoxyphenyl)methyl]-1,2-oxazol-5-yl]pyridin-2-amine
CID 67130843
3-[3-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine
CID 138682145
3-[3-[[4-[(5-fluoro-3-pyridinyl)methoxy]phenyl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine
CID 138682375
3-[3-[[6-[(2S)-2-phenylazetidin-1-yl]-3-pyridinyl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine
CID 138682214
3-[3-[[6-(thiophen-2-ylmethoxy)-3-pyridinyl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine
CID 138682443
3-[3-[[4-[(2,6-difluoro-4-pyridinyl)methyl]phenyl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine
CID 138682322
3-[3-[[2-[(2,6-dichloro-4-pyridinyl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-4,5-dihydro-1,2-oxazol-5-yl]pyridin-2-amine
CID 170220163
3-[3-[[6-(1-pyridin-2-ylethoxy)-3-pyridinyl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine
CID 138682131
3-[3-[[6-[(2-bromo-4-pyridinyl)methoxy]-3-pyridinyl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine
CID 138682075

Frequently Asked Questions

What is the IUPAC name of 3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine?
The IUPAC name of 3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine (CID 170219787) is 3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine.
What is the SMILES notation for 3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine?
The canonical SMILES for 3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine is Cn1cc(COC2C=CC(Cc3cc(-c4cccnc4N)on3)=CN2)cn1.
What is the InChIKey of 3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine?
The InChIKey is PGEAZTQRJNRATH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O2/c1-25-11-14(10-23-25)12-26-18-5-4-13(9-22-18)7-15-8-17(27-24-15)16-3-2-6-21-19(16)20/h2-6,8-11,18,22H,7,12H2,1H3,(H2,20,21).
What are the key properties of 3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine?
3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine has a molecular weight of 364.41 g/mol, XLogP of 2.18, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[[2-[(1-methylpyrazol-4-yl)methoxy]-1,2-dihydropyridin-5-yl]methyl]-1,2-oxazol-5-yl]pyridin-2-amine is sourced from PubChem (CID 170219787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).