N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide

C20H20N4O2 — CID 113034520

IUPACN-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide
SMILESCC(C)Oc1ccccc1Nc1ccc(NC(=O)c2cccnc2)nc1
InChIInChI=1S/C20H20N4O2/c1-14(2)26-18-8-4-3-7-17(18)23-16-9-10-19(22-13-16)24-20(25)15-6-5-11-21-12-15/h3-14,23H,1-2H3,(H,22,24,25)
InChIKeyLKHNQIZBPNGXNI-UHFFFAOYSA-N
MW348.41 g/mol
LogP4.26
Rot. Bonds6

About N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide

N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide (PubChem CID 113034520) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide
PubChem CID113034520
Molecular FormulaC20H20N4O2
Molecular Weight348.41 g/mol
Exact Mass348.16
IUPAC NameN-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide
SMILESCC(C)Oc1ccccc1Nc1ccc(NC(=O)c2cccnc2)nc1
InChIInChI=1S/C20H20N4O2/c1-14(2)26-18-8-4-3-7-17(18)23-16-9-10-19(22-13-16)24-20(25)15-6-5-11-21-12-15/h3-14,23H,1-2H3,(H,22,24,25)
InChIKeyLKHNQIZBPNGXNI-UHFFFAOYSA-N
XLogP4.26
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-methoxy-N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]benzamide
CID 113034507
N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]-1,3-benzodioxole-5-carboxamide
CID 113034521
N-[5-(4-methylanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113031564
2-ethyl-N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]butanamide
CID 113034496
N-[5-(butan-2-ylamino)-2-pyridinyl]pyridine-3-carboxamide
CID 113024266
N-[6-(2-propan-2-yloxyanilino)pyridazin-3-yl]benzamide
CID 113048623
N-[5-(4-ethoxyanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113034364
N-[5-(3-methoxyanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113034083
2-(2-fluorophenyl)-N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]acetamide
CID 113034524
N-[5-(2-bromo-4-methylanilino)-2-pyridinyl]pyridine-3-carboxamide
CID 113036060
2,2-dimethyl-N-[6-(2-propan-2-yloxyanilino)-3-pyridinyl]propanamide
CID 113019828
methyl N-[6-(2-propan-2-yloxyanilino)-3-pyridinyl]carbamate
CID 113019866

Frequently Asked Questions

What is the IUPAC name of N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide?
The IUPAC name of N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide (CID 113034520) is N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide?
The canonical SMILES for N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide is CC(C)Oc1ccccc1Nc1ccc(NC(=O)c2cccnc2)nc1.
What is the InChIKey of N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide?
The InChIKey is LKHNQIZBPNGXNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O2/c1-14(2)26-18-8-4-3-7-17(18)23-16-9-10-19(22-13-16)24-20(25)15-6-5-11-21-12-15/h3-14,23H,1-2H3,(H,22,24,25).
What are the key properties of N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide?
N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide has a molecular weight of 348.41 g/mol, XLogP of 4.26, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-propan-2-yloxyanilino)-2-pyridinyl]pyridine-3-carboxamide is sourced from PubChem (CID 113034520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).