1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone

C17H19NO2 — CID 143285715

IUPAC1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone
SMILESCC(=O)CN.Cc1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C14H12O.C3H7NO/c1-11-7-5-6-10-13(11)14(15)12-8-3-2-4-9-12;1-3(5)2-4/h2-10H,1H3;2,4H2,1H3
InChIKeyOCXUIDWPBQDQFE-UHFFFAOYSA-N
MW269.34 g/mol
LogP2.76
Rot. Bonds3

About 1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone

1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone (PubChem CID 143285715) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone.

Molecular Properties

Compound Name1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone
PubChem CID143285715
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone
SMILESCC(=O)CN.Cc1ccccc1C(=O)c1ccccc1
InChIInChI=1S/C14H12O.C3H7NO/c1-11-7-5-6-10-13(11)14(15)12-8-3-2-4-9-12;1-3(5)2-4/h2-10H,1H3;2,4H2,1H3
InChIKeyOCXUIDWPBQDQFE-UHFFFAOYSA-N
XLogP2.76
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-methylphenyl)-phenylmethanone;1-phenylpropan-1-one
CID 175125540
(2-methylphenyl)-(4-methylphenyl)methanone
CID 6613295
2-formyloxyacetic acid;(2-methylphenyl)-phenylmethanone
CID 175031388
(2-methylphenyl)-pyridin-4-ylmethanone
CID 19957162
[2-(2-methylbenzoyl)phenyl]-(2-methylphenyl)methanone
CID 15597717
1-(2-methylphenyl)ethanone;1-phenylethanone
CID 160893925
2-(2-benzoylphenyl)-1-(2,3-dimethylphenyl)ethanone
CID 175001099
[2-[2-[2-(2-methylbenzoyl)phenyl]ethyl]phenyl]-(2-methylphenyl)methanone
CID 117071524
2-[2-[4-(2-methylbenzoyl)phenoxy]phenyl]acetic acid
CID 21320367
(3-hydroxyphenyl)-(2-methylphenyl)methanone
CID 68613493
sodium;(2-ethylphenyl)-phenylmethanone;hydride
CID 175475173
[3,5-dihydroxy-4-methyl-2-(2-methylbenzoyl)phenyl]-phenylmethanone
CID 156662523

Frequently Asked Questions

What is the IUPAC name of 1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone?
The IUPAC name of 1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone (CID 143285715) is 1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone.
What is the SMILES notation for 1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone?
The canonical SMILES for 1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone is CC(=O)CN.Cc1ccccc1C(=O)c1ccccc1.
What is the InChIKey of 1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone?
The InChIKey is OCXUIDWPBQDQFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O.C3H7NO/c1-11-7-5-6-10-13(11)14(15)12-8-3-2-4-9-12;1-3(5)2-4/h2-10H,1H3;2,4H2,1H3.
What are the key properties of 1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone?
1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone has a molecular weight of 269.34 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-aminopropan-2-one;(2-methylphenyl)-phenylmethanone is sourced from PubChem (CID 143285715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).