2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide

C19H25N3O3 — CID 75375647

IUPAC2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide
SMILESCc1nc(C)c(C(=O)Nc2cccc(OCCN3CCCCC3)c2)o1
InChIInChI=1S/C19H25N3O3/c1-14-18(25-15(2)20-14)19(23)21-16-7-6-8-17(13-16)24-12-11-22-9-4-3-5-10-22/h6-8,13H,3-5,9-12H2,1-2H3,(H,21,23)
InChIKeyQHVWBWIZIKYHQQ-UHFFFAOYSA-N
MW343.43 g/mol
LogP3.41
Rot. Bonds6

About 2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide

2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide (PubChem CID 75375647) has the molecular formula C19H25N3O3 and a molecular weight of 343.43 g/mol. Its IUPAC name is 2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound Name2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide
PubChem CID75375647
Molecular FormulaC19H25N3O3
Molecular Weight343.43 g/mol
Exact Mass343.19
IUPAC Name2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide
SMILESCc1nc(C)c(C(=O)Nc2cccc(OCCN3CCCCC3)c2)o1
InChIInChI=1S/C19H25N3O3/c1-14-18(25-15(2)20-14)19(23)21-16-7-6-8-17(13-16)24-12-11-22-9-4-3-5-10-22/h6-8,13H,3-5,9-12H2,1-2H3,(H,21,23)
InChIKeyQHVWBWIZIKYHQQ-UHFFFAOYSA-N
XLogP3.41
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(azepan-1-yl)-N-[3-(2-methoxyethoxy)phenyl]acetamide
CID 54814501
4-methyl-3-oxo-N-[3-(2-pyrrolidin-1-ylethoxy)phenyl]-1,4-benzoxazine-5-carboxamide
CID 166292593
3-(4-methylphenyl)-N-[3-(2-piperidin-1-ylethoxy)phenyl]-8,9-dihydro-7H-benzo[7]annulene-6-carboxamide
CID 143836383
2-piperidin-1-ylethyl N-(3-propan-2-yloxyphenyl)carbamate
CID 23275932
1-[3-(2-piperidin-1-ylethoxy)phenyl]-3-[3-(1H-pyrazol-5-yl)phenyl]urea
CID 139434928
3-piperidin-1-ylpropyl N-(3-nonoxyphenyl)carbamate
CID 15937470
3-[2-(azocan-1-yl)ethoxy]benzoic acid
CID 43532593
N-[4-methyl-3-[2-[2-[3-(2-pyrrolidin-1-ylethoxy)anilino]pyrimidin-5-yl]acetyl]phenyl]benzamide
CID 123386547
2-piperidin-1-ylethyl N-(3-phenylmethoxyphenyl)carbamate;hydrochloride
CID 138398426
1-[3-(2-piperidin-1-ylethoxy)phenyl]-3-[2-(1H-pyrazol-5-yl)phenyl]urea
CID 139434962
1-[3-(2-piperidin-1-ylethoxy)phenyl]-3-[2-(2H-pyrrol-3-yl)phenyl]urea
CID 162142467
N-[5-[[3-(fluoromethyl)benzoyl]amino]-2-methylphenyl]-2-[3-(2-pyrrolidin-1-ylethoxy)anilino]pyrimidine-5-carboxamide
CID 71133390

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide?
The IUPAC name of 2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide (CID 75375647) is 2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide.
What is the SMILES notation for 2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide?
The canonical SMILES for 2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide is Cc1nc(C)c(C(=O)Nc2cccc(OCCN3CCCCC3)c2)o1.
What is the InChIKey of 2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide?
The InChIKey is QHVWBWIZIKYHQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O3/c1-14-18(25-15(2)20-14)19(23)21-16-7-6-8-17(13-16)24-12-11-22-9-4-3-5-10-22/h6-8,13H,3-5,9-12H2,1-2H3,(H,21,23).
What are the key properties of 2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide?
2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 3.41, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-N-[3-(2-piperidin-1-ylethoxy)phenyl]-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 75375647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).