6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide

C14H17N5O — CID 81233882

IUPAC6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide
SMILESCCCNc1cc(C)ncc1C(=O)Nc1ncccn1
InChIInChI=1S/C14H17N5O/c1-3-5-15-12-8-10(2)18-9-11(12)13(20)19-14-16-6-4-7-17-14/h4,6-9H,3,5H2,1-2H3,(H,15,18)(H,16,17,19,20)
InChIKeyHGOPZXPZGWLLGC-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.25
Rot. Bonds5

About 6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide

6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide (PubChem CID 81233882) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide
PubChem CID81233882
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide
SMILESCCCNc1cc(C)ncc1C(=O)Nc1ncccn1
InChIInChI=1S/C14H17N5O/c1-3-5-15-12-8-10(2)18-9-11(12)13(20)19-14-16-6-4-7-17-14/h4,6-9H,3,5H2,1-2H3,(H,15,18)(H,16,17,19,20)
InChIKeyHGOPZXPZGWLLGC-UHFFFAOYSA-N
XLogP2.25
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-methyl-N-(4-methyl-3-pyridinyl)-4-(propylamino)pyridine-3-carboxamide
CID 81235489
N-(4-chlorophenyl)-6-methyl-4-(propylamino)pyridine-3-carboxamide
CID 81238211
N-butyl-6-methyl-4-(propylamino)pyridine-3-carboxamide
CID 81235324
6-methyl-N-(6-oxo-1H-pyridazin-3-yl)-4-(propylamino)pyridine-3-carboxamide
CID 116787996
6-methyl-N-[2-oxo-2-(propylamino)ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 81237526
N-[2-(ethylamino)-2-oxoethyl]-6-methyl-4-(propylamino)pyridine-3-carboxamide
CID 81243009
N-(3-amino-3-oxopropyl)-6-methyl-4-(propylamino)pyridine-3-carboxamide
CID 81243302
4-(ethylamino)-6-methyl-N-pyridin-2-ylpyridine-3-carboxamide
CID 81236954
4-(ethylamino)-6-methyl-N-propylpyridine-3-carboxamide
CID 81236373
6-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]-4-(propylamino)pyridine-3-carboxamide
CID 81237936
6-methyl-N-(1-methylcyclohexyl)-4-(propylamino)pyridine-3-carboxamide
CID 81238446
6-methyl-N-[1-(methylamino)-1-oxopropan-2-yl]-4-(propylamino)pyridine-3-carboxamide
CID 81240178

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide?
The IUPAC name of 6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide (CID 81233882) is 6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide?
The canonical SMILES for 6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide is CCCNc1cc(C)ncc1C(=O)Nc1ncccn1.
What is the InChIKey of 6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide?
The InChIKey is HGOPZXPZGWLLGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-3-5-15-12-8-10(2)18-9-11(12)13(20)19-14-16-6-4-7-17-14/h4,6-9H,3,5H2,1-2H3,(H,15,18)(H,16,17,19,20).
What are the key properties of 6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide?
6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.25, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 81233882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).