N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide

C15H20N4O2 — CID 106377308

IUPACN-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccncc1C(=O)NCc1nc(C)c(C)o1
InChIInChI=1S/C15H20N4O2/c1-4-6-17-13-5-7-16-8-12(13)15(20)18-9-14-19-10(2)11(3)21-14/h5,7-8H,4,6,9H2,1-3H3,(H,16,17)(H,18,20)
InChIKeyUYMOMSAIQHWHOV-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.44
Rot. Bonds6

About N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide

N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide (PubChem CID 106377308) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide
PubChem CID106377308
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC NameN-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccncc1C(=O)NCc1nc(C)c(C)o1
InChIInChI=1S/C15H20N4O2/c1-4-6-17-13-5-7-16-8-12(13)15(20)18-9-14-19-10(2)11(3)21-14/h5,7-8H,4,6,9H2,1-3H3,(H,16,17)(H,18,20)
InChIKeyUYMOMSAIQHWHOV-UHFFFAOYSA-N
XLogP2.44
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3-methyl-4-pyridinyl)methyl]-4-(propylamino)pyridine-3-carboxamide
CID 114701819
N-[(2-methyl-1,3-thiazol-4-yl)methyl]-4-(propylamino)pyridine-3-carboxamide
CID 81240490
N-[2-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 106422913
N-[2-(carbamoylamino)ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 83115001
4-(propylamino)-N-(thiophen-3-ylmethyl)pyridine-3-carboxamide
CID 81241625
N-[3-oxo-3-(propylamino)propyl]-4-(propylamino)pyridine-3-carboxamide
CID 81237252
N-[2-[ethyl(methyl)amino]ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 81240941
N-(2-methylsulfonylethyl)-4-(propylamino)pyridine-3-carboxamide
CID 81234637
4-(propylamino)-N-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
CID 81240630
N-(3-amino-2,2-dimethyl-3-oxopropyl)-4-(propylamino)pyridine-3-carboxamide
CID 106280042
N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide
CID 81239346
N-[(3-methyl-4-pyridinyl)methyl]-3-(propylamino)pyridine-4-carboxamide
CID 105071463

Frequently Asked Questions

What is the IUPAC name of N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide (CID 106377308) is N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide is CCCNc1ccncc1C(=O)NCc1nc(C)c(C)o1.
What is the InChIKey of N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide?
The InChIKey is UYMOMSAIQHWHOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-4-6-17-13-5-7-16-8-12(13)15(20)18-9-14-19-10(2)11(3)21-14/h5,7-8H,4,6,9H2,1-3H3,(H,16,17)(H,18,20).
What are the key properties of N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide?
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 2.44, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-4-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 106377308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).