N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide

C15H19N5O — CID 81239346

IUPACN-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccncc1C(=O)Nc1nc(C)cc(C)n1
InChIInChI=1S/C15H19N5O/c1-4-6-17-13-5-7-16-9-12(13)14(21)20-15-18-10(2)8-11(3)19-15/h5,7-9H,4,6H2,1-3H3,(H,16,17)(H,18,19,20,21)
InChIKeyDKEHLBKQRJLBHN-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.56
Rot. Bonds5

About N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide

N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide (PubChem CID 81239346) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide
PubChem CID81239346
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC NameN-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccncc1C(=O)Nc1nc(C)cc(C)n1
InChIInChI=1S/C15H19N5O/c1-4-6-17-13-5-7-16-9-12(13)14(21)20-15-18-10(2)8-11(3)19-15/h5,7-9H,4,6H2,1-3H3,(H,16,17)(H,18,19,20,21)
InChIKeyDKEHLBKQRJLBHN-UHFFFAOYSA-N
XLogP2.56
TPSA79.80 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methyl-4-pyridinyl)-4-(propylamino)pyridine-3-carboxamide
CID 81245840
N-(6-methyl-2-pyridinyl)-4-(propylamino)pyridine-3-carboxamide
CID 81235208
N-(5-methyl-3-pyridinyl)-4-(propylamino)pyridine-3-carboxamide
CID 107586622
N-(2,5-dichlorophenyl)-4-(propylamino)pyridine-3-carboxamide
CID 81237097
N-[2-(carbamoylamino)ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 83115001
N-(2-chloro-4-iodophenyl)-4-(propylamino)pyridine-3-carboxamide
CID 107606051
N-(2-chloro-4-fluorophenyl)-4-(propylamino)pyridine-3-carboxamide
CID 81237149
N-[(3-methyl-4-pyridinyl)methyl]-4-(propylamino)pyridine-3-carboxamide
CID 114701819
6-methyl-N-(4-methyl-3-pyridinyl)-4-(propylamino)pyridine-3-carboxamide
CID 81235489
N-(3-chloro-5-fluorophenyl)-4-(propylamino)pyridine-3-carboxamide
CID 107370476
N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)pyridine-3-carboxamide
CID 114389358
N-(4-methyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105068083

Frequently Asked Questions

What is the IUPAC name of N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide (CID 81239346) is N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide is CCCNc1ccncc1C(=O)Nc1nc(C)cc(C)n1.
What is the InChIKey of N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide?
The InChIKey is DKEHLBKQRJLBHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-4-6-17-13-5-7-16-9-12(13)14(21)20-15-18-10(2)8-11(3)19-15/h5,7-9H,4,6H2,1-3H3,(H,16,17)(H,18,19,20,21).
What are the key properties of N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide?
N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.56, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,6-dimethylpyrimidin-2-yl)-4-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 81239346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).