N-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine

C12H15N3O2 — CID 61379672

IUPACN-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine
SMILESCC(C)Oc1ncccc1NCc1cnoc1
InChIInChI=1S/C12H15N3O2/c1-9(2)17-12-11(4-3-5-13-12)14-6-10-7-15-16-8-10/h3-5,7-9,14H,6H2,1-2H3
InChIKeyYCHRDMQTECBQDO-UHFFFAOYSA-N
MW233.27 g/mol
LogP2.47
Rot. Bonds5

About N-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine

N-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine (PubChem CID 61379672) has the molecular formula C12H15N3O2 and a molecular weight of 233.27 g/mol. Its IUPAC name is N-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine.

Molecular Properties

Compound NameN-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine
PubChem CID61379672
Molecular FormulaC12H15N3O2
Molecular Weight233.27 g/mol
Exact Mass233.12
IUPAC NameN-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine
SMILESCC(C)Oc1ncccc1NCc1cnoc1
InChIInChI=1S/C12H15N3O2/c1-9(2)17-12-11(4-3-5-13-12)14-6-10-7-15-16-8-10/h3-5,7-9,14H,6H2,1-2H3
InChIKeyYCHRDMQTECBQDO-UHFFFAOYSA-N
XLogP2.47
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.27
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[2-(4-methylpiperazin-1-yl)pyrimidin-5-yl]methyl]-2-propan-2-yloxypyridin-3-amine
CID 75386232
N-[(1-methylpyrazol-4-yl)methyl]-2-propan-2-yloxypyridin-3-amine
CID 61375775
N-[(3-bromophenyl)methyl]-2-propan-2-yloxypyridin-3-amine
CID 63454228
2-propan-2-yloxy-N-(thiophen-3-ylmethyl)pyridin-3-amine
CID 61375576
N-ethyl-2-propan-2-yloxypyridin-3-amine
CID 61374229
N-[(5-methylfuran-2-yl)methyl]-2-propan-2-yloxypyridin-3-amine
CID 61375572
N-(1,2-oxazol-4-ylmethyl)-2-propan-2-ylaniline
CID 60869621
N-(1H-imidazol-5-ylmethyl)-2-propan-2-yloxypyridin-3-amine
CID 62763918
2-bromo-4-[[(2-propan-2-yloxy-3-pyridinyl)amino]methyl]phenol
CID 63047282
2-propan-2-yloxy-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine
CID 61373861
2-ethoxy-N-[(4-propan-2-yloxyphenyl)methyl]pyridin-3-amine
CID 43784042
N-[(3-propan-2-ylimidazol-4-yl)methyl]-2-propan-2-yloxypyridin-3-amine
CID 66162966

Frequently Asked Questions

What is the IUPAC name of N-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine?
The IUPAC name of N-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine (CID 61379672) is N-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine.
What is the SMILES notation for N-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine?
The canonical SMILES for N-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine is CC(C)Oc1ncccc1NCc1cnoc1.
What is the InChIKey of N-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine?
The InChIKey is YCHRDMQTECBQDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2/c1-9(2)17-12-11(4-3-5-13-12)14-6-10-7-15-16-8-10/h3-5,7-9,14H,6H2,1-2H3.
What are the key properties of N-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine?
N-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine has a molecular weight of 233.27 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-oxazol-4-ylmethyl)-2-propan-2-yloxypyridin-3-amine is sourced from PubChem (CID 61379672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).