[4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine

C14H15N3O — CID 82387350

IUPAC[4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine
SMILESCc1nc(CN)oc1-c1cc2ccccc2n1C
InChIInChI=1S/C14H15N3O/c1-9-14(18-13(8-15)16-9)12-7-10-5-3-4-6-11(10)17(12)2/h3-7H,8,15H2,1-2H3
InChIKeyZBLOZEYZFWHJQE-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.60
Rot. Bonds2

About [4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine

[4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine (PubChem CID 82387350) has the molecular formula C14H15N3O and a molecular weight of 241.29 g/mol. Its IUPAC name is [4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine.

Molecular Properties

Compound Name[4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine
PubChem CID82387350
Molecular FormulaC14H15N3O
Molecular Weight241.29 g/mol
Exact Mass241.12
IUPAC Name[4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine
SMILESCc1nc(CN)oc1-c1cc2ccccc2n1C
InChIInChI=1S/C14H15N3O/c1-9-14(18-13(8-15)16-9)12-7-10-5-3-4-6-11(10)17(12)2/h3-7H,8,15H2,1-2H3
InChIKeyZBLOZEYZFWHJQE-UHFFFAOYSA-N
XLogP2.60
TPSA56.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[5-(2-methoxyphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine
CID 82079249
benzene;1-methyl-2-phenylindole
CID 158316839
[5-(4-chlorophenyl)-4-methyl-1,3-oxazol-2-yl]methanamine
CID 71683764
[5-(2-methoxy-4,5-dimethylphenyl)-4-methyl-1,3-oxazol-2-yl]methanamine
CID 82086154
5-(1-methylindol-2-yl)pyridin-3-amine
CID 58215579
[5-(6-fluoro-1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine
CID 82385260
5-(1-methylindol-2-yl)-1H-pyrazol-4-amine
CID 115109269
1-methyl-2-(4-methylcyclohexa-1,3-dien-1-yl)indole
CID 173189823
2-(2-bromophenyl)-1-methylindole
CID 127263547
3-amino-1-methylquinolin-2-one
CID 19417653
(E)-3-(1-methylindol-2-yl)prop-2-enal
CID 146445442
ethyl 2-(1-methylindol-2-yl)-1,3-thiazole-4-carboxylate
CID 131875535

Frequently Asked Questions

What is the IUPAC name of [4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine?
The IUPAC name of [4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine (CID 82387350) is [4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine.
What is the SMILES notation for [4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine?
The canonical SMILES for [4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine is Cc1nc(CN)oc1-c1cc2ccccc2n1C.
What is the InChIKey of [4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine?
The InChIKey is ZBLOZEYZFWHJQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O/c1-9-14(18-13(8-15)16-9)12-7-10-5-3-4-6-11(10)17(12)2/h3-7H,8,15H2,1-2H3.
What are the key properties of [4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine?
[4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine has a molecular weight of 241.29 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-5-(1-methylindol-2-yl)-1,3-oxazol-2-yl]methanamine is sourced from PubChem (CID 82387350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).