4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide

C21H25N3O2 — CID 109080780

IUPAC4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
SMILESCC(C)c1ccc(NC(=O)c2cc(C(=O)NC3CCCC3)ccn2)cc1
InChIInChI=1S/C21H25N3O2/c1-14(2)15-7-9-18(10-8-15)24-21(26)19-13-16(11-12-22-19)20(25)23-17-5-3-4-6-17/h7-14,17H,3-6H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyLVLKBMZXIXTDDV-UHFFFAOYSA-N
MW351.45 g/mol
LogP4.13
Rot. Bonds5

About 4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide

4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109080780) has the molecular formula C21H25N3O2 and a molecular weight of 351.45 g/mol. Its IUPAC name is 4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
PubChem CID109080780
Molecular FormulaC21H25N3O2
Molecular Weight351.45 g/mol
Exact Mass351.19
IUPAC Name4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
SMILESCC(C)c1ccc(NC(=O)c2cc(C(=O)NC3CCCC3)ccn2)cc1
InChIInChI=1S/C21H25N3O2/c1-14(2)15-7-9-18(10-8-15)24-21(26)19-13-16(11-12-22-19)20(25)23-17-5-3-4-6-17/h7-14,17H,3-6H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyLVLKBMZXIXTDDV-UHFFFAOYSA-N
XLogP4.13
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-cyclopentyl-2-N-(4-propan-2-yloxyphenyl)pyridine-2,4-dicarboxamide
CID 109080807
4-N-(4-chlorophenyl)-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109092487
3-N-cyclohexyl-1-N-(4-propan-2-ylphenyl)benzene-1,3-dicarboxamide
CID 109052210
4-N-cyclopentyl-2-N-(4-ethoxyphenyl)pyridine-2,4-dicarboxamide
CID 109080804
1-N-cyclohexyl-4-N-(4-propan-2-ylphenyl)benzene-1,4-dicarboxamide
CID 109044795
2-N-(3,4-dimethylphenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109091918
4-N-cyclohexyl-2-N-(3,5-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109081429
2-N-(3-chloro-4-fluorophenyl)-4-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080795
4-N-(3-chloro-4-methylphenyl)-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080961
2-N-(3-chloro-4-methylphenyl)-4-N-cyclopropylpyridine-2,4-dicarboxamide
CID 109078522
4-(cyclopropylamino)-N-(4-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109201983
2-N-cyclopentyl-4-N-(3,5-dichlorophenyl)pyridine-2,4-dicarboxamide
CID 109081008

Frequently Asked Questions

What is the IUPAC name of 4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide (CID 109080780) is 4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide is CC(C)c1ccc(NC(=O)c2cc(C(=O)NC3CCCC3)ccn2)cc1.
What is the InChIKey of 4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is LVLKBMZXIXTDDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O2/c1-14(2)15-7-9-18(10-8-15)24-21(26)19-13-16(11-12-22-19)20(25)23-17-5-3-4-6-17/h7-14,17H,3-6H2,1-2H3,(H,23,25)(H,24,26).
What are the key properties of 4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide?
4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 351.45 g/mol, XLogP of 4.13, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclopentyl-2-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109080780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).