N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine

C12H14N2O — CID 103738795

IUPACN-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine
SMILESCc1cnc(CNCc2ccccc2)o1
InChIInChI=1S/C12H14N2O/c1-10-7-14-12(15-10)9-13-8-11-5-3-2-4-6-11/h2-7,13H,8-9H2,1H3
InChIKeySIXFKPJRMCQRHP-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.27
Rot. Bonds4

About N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine

N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine (PubChem CID 103738795) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine.

Molecular Properties

Compound NameN-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine
PubChem CID103738795
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC NameN-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine
SMILESCc1cnc(CNCc2ccccc2)o1
InChIInChI=1S/C12H14N2O/c1-10-7-14-12(15-10)9-13-8-11-5-3-2-4-6-11/h2-7,13H,8-9H2,1H3
InChIKeySIXFKPJRMCQRHP-UHFFFAOYSA-N
XLogP2.27
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[(5-methyl-1,3-oxazol-2-yl)methylamino]methyl]benzonitrile
CID 113252142
1-(furan-3-yl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine
CID 103275486
1-(3,5-difluorophenyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine
CID 103275502
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-2-phenylacetamide
CID 110660350
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-(5-phenyl-2H-triazol-4-yl)methanamine
CID 106369481
5-[[(5-methyl-1,3-oxazol-2-yl)methylamino]methyl]-1-benzofuran-2-carboxylic acid
CID 106373614
2-[3-[[(5-methyl-1,3-oxazol-2-yl)methylamino]methyl]phenoxy]acetonitrile
CID 106370104
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-(1H-pyrrol-2-yl)methanamine
CID 103578837
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-[2-(trifluoromethyl)phenyl]methanamine
CID 103738802
1-(5-bromo-3-pyridinyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine
CID 103275561
1-(2-methoxy-3-pyridinyl)-N-[(5-methyl-1,3-oxazol-2-yl)methyl]methanamine
CID 114180399
2-[(5-methyl-1,3-oxazol-2-yl)methylamino]acetic acid
CID 106372016

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine?
The IUPAC name of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine (CID 103738795) is N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine.
What is the SMILES notation for N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine?
The canonical SMILES for N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine is Cc1cnc(CNCc2ccccc2)o1.
What is the InChIKey of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine?
The InChIKey is SIXFKPJRMCQRHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-10-7-14-12(15-10)9-13-8-11-5-3-2-4-6-11/h2-7,13H,8-9H2,1H3.
What are the key properties of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine?
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine has a molecular weight of 202.26 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1,3-oxazol-2-yl)methyl]-1-phenylmethanamine is sourced from PubChem (CID 103738795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).