N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide

C19H25N3O2 — CID 56906763

IUPACN-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide
SMILESCC(c1ccon1)N(C)C(=O)c1cccc(CC2CCNCC2)c1
InChIInChI=1S/C19H25N3O2/c1-14(18-8-11-24-21-18)22(2)19(23)17-5-3-4-16(13-17)12-15-6-9-20-10-7-15/h3-5,8,11,13-15,20H,6-7,9-10,12H2,1-2H3
InChIKeyMZJGGTIZXXQHHI-UHFFFAOYSA-N
MW327.43 g/mol
LogP3.05
Rot. Bonds5

About N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide

N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide (PubChem CID 56906763) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide.

Molecular Properties

Compound NameN-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide
PubChem CID56906763
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC NameN-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide
SMILESCC(c1ccon1)N(C)C(=O)c1cccc(CC2CCNCC2)c1
InChIInChI=1S/C19H25N3O2/c1-14(18-8-11-24-21-18)22(2)19(23)17-5-3-4-16(13-17)12-15-6-9-20-10-7-15/h3-5,8,11,13-15,20H,6-7,9-10,12H2,1-2H3
InChIKeyMZJGGTIZXXQHHI-UHFFFAOYSA-N
XLogP3.05
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide?
The IUPAC name of N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide (CID 56906763) is N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide.
What is the SMILES notation for N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide?
The canonical SMILES for N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide is CC(c1ccon1)N(C)C(=O)c1cccc(CC2CCNCC2)c1.
What is the InChIKey of N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide?
The InChIKey is MZJGGTIZXXQHHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-14(18-8-11-24-21-18)22(2)19(23)17-5-3-4-16(13-17)12-15-6-9-20-10-7-15/h3-5,8,11,13-15,20H,6-7,9-10,12H2,1-2H3.
What are the key properties of N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide?
N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide has a molecular weight of 327.43 g/mol, XLogP of 3.05, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(1,2-oxazol-3-yl)ethyl]-3-(piperidin-4-ylmethyl)benzamide is sourced from PubChem (CID 56906763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).