N-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide

C14H17N3O2 — CID 120826619

IUPACN-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide
SMILESCNC(C)CNC(=O)c1ccc(-c2cnco2)cc1
InChIInChI=1S/C14H17N3O2/c1-10(15-2)7-17-14(18)12-5-3-11(4-6-12)13-8-16-9-19-13/h3-6,8-10,15H,7H2,1-2H3,(H,17,18)
InChIKeyNZAMCZUJVJEKBL-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.68
Rot. Bonds5

About N-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide

N-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide (PubChem CID 120826619) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide.

Molecular Properties

Compound NameN-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide
PubChem CID120826619
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide
SMILESCNC(C)CNC(=O)c1ccc(-c2cnco2)cc1
InChIInChI=1S/C14H17N3O2/c1-10(15-2)7-17-14(18)12-5-3-11(4-6-12)13-8-16-9-19-13/h3-6,8-10,15H,7H2,1-2H3,(H,17,18)
InChIKeyNZAMCZUJVJEKBL-UHFFFAOYSA-N
XLogP1.68
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(1,3-oxazol-5-yl)-N-prop-2-ynylbenzamide
CID 47262158
N-[(2R)-2-(4-ethylpiperazin-1-yl)propyl]-4-(1,3-oxazol-5-yl)benzamide
CID 95327535
N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-4-(1,3-oxazol-5-yl)benzamide
CID 55836198
1-[4-(1,3-oxazol-5-yl)phenyl]ethanone
CID 22316930
1-methyl-N-[2-(methylamino)propyl]pyrazole-4-carboxamide
CID 103512630
2-methyl-N-[2-(methylamino)propyl]-1,3-dioxoisoindole-5-carboxamide
CID 120827153
4-N-(2,2-dimethylpropyl)-1-N-[2-(methylamino)propyl]benzene-1,4-dicarboxamide;hydrochloride
CID 120830958
4-N,4-N-diethyl-1-N-[2-(methylamino)propyl]benzene-1,4-dicarboxamide
CID 120828485
6-(dimethylamino)-N-[2-(methylamino)propyl]pyridine-3-carboxamide
CID 120828209
3-(ethylamino)-2-methyl-N-[4-(1,3-oxazol-5-yl)phenyl]propanamide
CID 62853092
N-[2-(methylamino)propyl]furan-3-carboxamide
CID 103512728
3,4-dihydroxy-N-[2-(methylamino)propyl]benzamide
CID 107728277

Frequently Asked Questions

What is the IUPAC name of N-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide?
The IUPAC name of N-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide (CID 120826619) is N-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide.
What is the SMILES notation for N-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide?
The canonical SMILES for N-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide is CNC(C)CNC(=O)c1ccc(-c2cnco2)cc1.
What is the InChIKey of N-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide?
The InChIKey is NZAMCZUJVJEKBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-10(15-2)7-17-14(18)12-5-3-11(4-6-12)13-8-16-9-19-13/h3-6,8-10,15H,7H2,1-2H3,(H,17,18).
What are the key properties of N-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide?
N-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide has a molecular weight of 259.31 g/mol, XLogP of 1.68, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylamino)propyl]-4-(1,3-oxazol-5-yl)benzamide is sourced from PubChem (CID 120826619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).