6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide

C17H24N4O2 — CID 48675917

IUPAC6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide
SMILESCCN(CC)c1ccc(C(=O)N(C)Cc2c(C)noc2C)cn1
InChIInChI=1S/C17H24N4O2/c1-6-21(7-2)16-9-8-14(10-18-16)17(22)20(5)11-15-12(3)19-23-13(15)4/h8-10H,6-7,11H2,1-5H3
InChIKeyJDYJKJNWWBXAKL-UHFFFAOYSA-N
MW316.41 g/mol
LogP2.80
Rot. Bonds6

About 6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide

6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide (PubChem CID 48675917) has the molecular formula C17H24N4O2 and a molecular weight of 316.41 g/mol. Its IUPAC name is 6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide
PubChem CID48675917
Molecular FormulaC17H24N4O2
Molecular Weight316.41 g/mol
Exact Mass316.19
IUPAC Name6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide
SMILESCCN(CC)c1ccc(C(=O)N(C)Cc2c(C)noc2C)cn1
InChIInChI=1S/C17H24N4O2/c1-6-21(7-2)16-9-8-14(10-18-16)17(22)20(5)11-15-12(3)19-23-13(15)4/h8-10H,6-7,11H2,1-5H3
InChIKeyJDYJKJNWWBXAKL-UHFFFAOYSA-N
XLogP2.80
TPSA62.47 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.41
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3,5-dibromo-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylbenzamide
CID 103907755
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-4-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 55641872
3-bromo-5-chloro-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylbenzamide
CID 103826474
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N,4-dimethyl-1,3-thiazole-5-carboxamide
CID 47209103
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-4-(6-propan-2-ylpyridazin-3-yl)benzamide
CID 122568132
2-tert-butylsulfanyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-4-carboxamide
CID 75499116
1-benzyl-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyrazole-4-carboxamide
CID 75461031
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-[(4-ethoxyphenyl)sulfonylamino]-N-methylbenzamide
CID 55621572
2-amino-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylbenzamide
CID 60959336
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-1-ethyl-1-methylurea
CID 115604567
6-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propylamino]-N,N-dimethylpyridine-3-carboxamide
CID 133347459
methyl 4-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl-methylcarbamoyl]phenyl]-1-methylpyrazole-3-carboxylate
CID 122570443

Frequently Asked Questions

What is the IUPAC name of 6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide?
The IUPAC name of 6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide (CID 48675917) is 6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide.
What is the SMILES notation for 6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide?
The canonical SMILES for 6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide is CCN(CC)c1ccc(C(=O)N(C)Cc2c(C)noc2C)cn1.
What is the InChIKey of 6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide?
The InChIKey is JDYJKJNWWBXAKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O2/c1-6-21(7-2)16-9-8-14(10-18-16)17(22)20(5)11-15-12(3)19-23-13(15)4/h8-10H,6-7,11H2,1-5H3.
What are the key properties of 6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide?
6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide has a molecular weight of 316.41 g/mol, XLogP of 2.80, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(diethylamino)-N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methylpyridine-3-carboxamide is sourced from PubChem (CID 48675917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).