N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine

C12H14N2O — CID 15761396

IUPACN,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine
SMILESCN(C)Cc1cc(-c2ccccc2)no1
InChIInChI=1S/C12H14N2O/c1-14(2)9-11-8-12(13-15-11)10-6-4-3-5-7-10/h3-8H,9H2,1-2H3
InChIKeyWTGOJGJYRSBYQN-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.40
Rot. Bonds3

About N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine

N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine (PubChem CID 15761396) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine
PubChem CID15761396
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC NameN,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine
SMILESCN(C)Cc1cc(-c2ccccc2)no1
InChIInChI=1S/C12H14N2O/c1-14(2)9-11-8-12(13-15-11)10-6-4-3-5-7-10/h3-8H,9H2,1-2H3
InChIKeyWTGOJGJYRSBYQN-UHFFFAOYSA-N
XLogP2.40
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N'-methyl-N'-[(3-phenyl-1,2-oxazol-5-yl)methyl]ethane-1,2-diamine
CID 62686446
2-[2-hydroxyethyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]ethanol
CID 62021320
N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1-thiophen-3-ylmethanamine
CID 56888188
N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]butane-1-sulfonamide
CID 71996846
2-[(3-phenyl-1,2-oxazol-5-yl)methyl-propylamino]acetic acid
CID 61006913
N-methyl-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1-pyrazin-2-ylpropan-2-amine
CID 77096482
N-methyl-1-[(2R)-oxan-2-yl]-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]methanamine
CID 99613583
N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-N-methyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine
CID 34323364
(1R)-1-[6-[methyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]-2-pyridinyl]ethanol
CID 97209953
2-[2-methylpropyl-[(3-phenyl-1,2-oxazol-5-yl)methyl]amino]acetic acid
CID 63065042
5-hexyl-3-phenyl-1,2-oxazole
CID 15445646
N-methyl-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-1-(3-pyridin-4-yl-1,2-oxazol-5-yl)methanamine
CID 91841578

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine?
The IUPAC name of N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine (CID 15761396) is N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine.
What is the SMILES notation for N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine?
The canonical SMILES for N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine is CN(C)Cc1cc(-c2ccccc2)no1.
What is the InChIKey of N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine?
The InChIKey is WTGOJGJYRSBYQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-14(2)9-11-8-12(13-15-11)10-6-4-3-5-7-10/h3-8H,9H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine?
N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine has a molecular weight of 202.26 g/mol, XLogP of 2.40, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(3-phenyl-1,2-oxazol-5-yl)methanamine is sourced from PubChem (CID 15761396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).