2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide

C23H22N4O2 — CID 10385484

IUPAC2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide
SMILESCN(Cc1ccccc1-c1cnc(Nc2cccc3ccccc23)o1)C(=O)CN
InChIInChI=1S/C23H22N4O2/c1-27(22(28)13-24)15-17-8-3-5-11-19(17)21-14-25-23(29-21)26-20-12-6-9-16-7-2-4-10-18(16)20/h2-12,14H,13,15,24H2,1H3,(H,25,26)
InChIKeyTXXTZAGQPAMOGS-UHFFFAOYSA-N
MW386.46 g/mol
LogP4.16
Rot. Bonds6

About 2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide

2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide (PubChem CID 10385484) has the molecular formula C23H22N4O2 and a molecular weight of 386.46 g/mol. Its IUPAC name is 2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide
PubChem CID10385484
Molecular FormulaC23H22N4O2
Molecular Weight386.46 g/mol
Exact Mass386.17
IUPAC Name2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide
SMILESCN(Cc1ccccc1-c1cnc(Nc2cccc3ccccc23)o1)C(=O)CN
InChIInChI=1S/C23H22N4O2/c1-27(22(28)13-24)15-17-8-3-5-11-19(17)21-14-25-23(29-21)26-20-12-6-9-16-7-2-4-10-18(16)20/h2-12,14H,13,15,24H2,1H3,(H,25,26)
InChIKeyTXXTZAGQPAMOGS-UHFFFAOYSA-N
XLogP4.16
TPSA84.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.46
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-methyl-N-[[2-[2-[4-(4-methyl-1,3-oxazol-2-yl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]acetamide
CID 10093415
2-amino-N-[[2-[2-[3-ethyl-4-(1,3-oxazol-5-yl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide
CID 10025760
2-amino-N-[[2-[2-[3-(4-bromo-1-methylpyrazol-3-yl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide
CID 10368518
2-amino-N-[[2-[2-[3-methoxy-4-(2-methylprop-1-enyl)anilino]-1,3-oxazol-5-yl]phenyl]methyl]-N-methylacetamide
CID 10409889
N-(2-fluorophenyl)-5-(2-methylphenyl)-1,3-oxazol-2-amine
CID 157218081
4-hydroxy-N-methyl-N-(naphthalen-1-ylmethyl)butanamide
CID 115163076
2-cyano-N-methyl-N-(naphthalen-1-ylmethyl)acetamide
CID 115173236
2-amino-N-[(2-methoxyphenyl)methyl]-N-methylacetamide
CID 60718962
3-[methyl-(2-naphthalen-1-ylacetyl)amino]propanoic acid
CID 60989846
N-methyl-N-(naphthalen-1-ylmethyl)carbamoyl bromide
CID 115193849
3-[5-(2,6-difluorophenyl)-1,3-oxazol-2-yl]-N-methyl-N-[(2-methylphenyl)methyl]propanamide
CID 30533858
N-[(2-hydroxyphenyl)methyl]-N-methyl-4-naphthalen-1-yloxybutanamide
CID 60518694

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide?
The IUPAC name of 2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide (CID 10385484) is 2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide.
What is the SMILES notation for 2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide?
The canonical SMILES for 2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide is CN(Cc1ccccc1-c1cnc(Nc2cccc3ccccc23)o1)C(=O)CN.
What is the InChIKey of 2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide?
The InChIKey is TXXTZAGQPAMOGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N4O2/c1-27(22(28)13-24)15-17-8-3-5-11-19(17)21-14-25-23(29-21)26-20-12-6-9-16-7-2-4-10-18(16)20/h2-12,14H,13,15,24H2,1H3,(H,25,26).
What are the key properties of 2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide?
2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide has a molecular weight of 386.46 g/mol, XLogP of 4.16, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-methyl-N-[[2-[2-(naphthalen-1-ylamino)-1,3-oxazol-5-yl]phenyl]methyl]acetamide is sourced from PubChem (CID 10385484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).