N-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide

C20H22N4O2 — CID 109161151

IUPACN-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide
SMILESCc1cc(Nc2ccc(C(=O)N(Cc3ccccc3)C(C)C)cn2)no1
InChIInChI=1S/C20H22N4O2/c1-14(2)24(13-16-7-5-4-6-8-16)20(25)17-9-10-18(21-12-17)22-19-11-15(3)26-23-19/h4-12,14H,13H2,1-3H3,(H,21,22,23)
InChIKeyQZLZDNWXHPHABA-UHFFFAOYSA-N
MW350.42 g/mol
LogP4.17
Rot. Bonds6

About N-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide

N-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide (PubChem CID 109161151) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is N-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide
PubChem CID109161151
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC NameN-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide
SMILESCc1cc(Nc2ccc(C(=O)N(Cc3ccccc3)C(C)C)cn2)no1
InChIInChI=1S/C20H22N4O2/c1-14(2)24(13-16-7-5-4-6-8-16)20(25)17-9-10-18(21-12-17)22-19-11-15(3)26-23-19/h4-12,14H,13H2,1-3H3,(H,21,22,23)
InChIKeyQZLZDNWXHPHABA-UHFFFAOYSA-N
XLogP4.17
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-benzyl-5-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide
CID 109239728
N-benzyl-6-(3-fluoroanilino)-N-propan-2-ylpyridine-3-carboxamide
CID 109161142
N-benzyl-6-(2-phenylethylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 109158221
N-benzyl-6-(pentylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 109161120
N-benzyl-6-(furan-2-ylmethylamino)-N-propan-2-ylpyridine-3-carboxamide
CID 109155319
6-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyridine-3-carboxamide
CID 109161118
N-benzyl-N-methyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]pyrimidine-4-carboxamide
CID 109348006
N-(2-tert-butylphenyl)-6-[(5-methyl-1,2-oxazol-3-yl)amino]pyridine-3-carboxamide
CID 109163149
5-[benzyl(propan-2-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrazine-2-carboxamide
CID 109287764
2-[benzyl(methyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)pyrimidine-5-carboxamide
CID 109256874
N-benzyl-3-bromo-4-methyl-N-propan-2-ylbenzamide
CID 81457215
5-(4-acetylanilino)-N-benzyl-N-propan-2-ylpyrazine-2-carboxamide
CID 109287695

Frequently Asked Questions

What is the IUPAC name of N-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide?
The IUPAC name of N-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide (CID 109161151) is N-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide.
What is the SMILES notation for N-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide?
The canonical SMILES for N-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide is Cc1cc(Nc2ccc(C(=O)N(Cc3ccccc3)C(C)C)cn2)no1.
What is the InChIKey of N-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide?
The InChIKey is QZLZDNWXHPHABA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-14(2)24(13-16-7-5-4-6-8-16)20(25)17-9-10-18(21-12-17)22-19-11-15(3)26-23-19/h4-12,14H,13H2,1-3H3,(H,21,22,23).
What are the key properties of N-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide?
N-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide has a molecular weight of 350.42 g/mol, XLogP of 4.17, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-6-[(5-methyl-1,2-oxazol-3-yl)amino]-N-propan-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 109161151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).