4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide

C25H35N5O2 — CID 67502547

IUPAC4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide
SMILESCCC(=O)N1CCC(c2ccc(Nc3cc(NC(C)C(C)C)c(C(N)=O)cn3)cc2)CC1
InChIInChI=1S/C25H35N5O2/c1-5-24(31)30-12-10-19(11-13-30)18-6-8-20(9-7-18)29-23-14-22(28-17(4)16(2)3)21(15-27-23)25(26)32/h6-9,14-17,19H,5,10-13H2,1-4H3,(H2,26,32)(H2,27,28,29)
InChIKeyYYCFHYDLSCYWNI-UHFFFAOYSA-N
MW437.59 g/mol
LogP4.50
Rot. Bonds8

About 4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide

4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide (PubChem CID 67502547) has the molecular formula C25H35N5O2 and a molecular weight of 437.59 g/mol. Its IUPAC name is 4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide.

Molecular Properties

Compound Name4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide
PubChem CID67502547
Molecular FormulaC25H35N5O2
Molecular Weight437.59 g/mol
Exact Mass437.28
IUPAC Name4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide
SMILESCCC(=O)N1CCC(c2ccc(Nc3cc(NC(C)C(C)C)c(C(N)=O)cn3)cc2)CC1
InChIInChI=1S/C25H35N5O2/c1-5-24(31)30-12-10-19(11-13-30)18-6-8-20(9-7-18)29-23-14-22(28-17(4)16(2)3)21(15-27-23)25(26)32/h6-9,14-17,19H,5,10-13H2,1-4H3,(H2,26,32)(H2,27,28,29)
InChIKeyYYCFHYDLSCYWNI-UHFFFAOYSA-N
XLogP4.50
TPSA100.35 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.59
LogP ≤ 54.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]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

4-[methyl-(1-methylpyrazol-4-yl)amino]-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide
CID 67501907
4-[methyl(pyridin-2-yl)amino]-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide
CID 67500903
4-[1H-indol-6-yl(methyl)amino]-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide
CID 67502761
4-(benzylamino)-6-[4-[1-(2-methoxyacetyl)azetidin-3-yl]anilino]pyridine-3-carboxamide
CID 67501741
6-[4-(oxan-4-yl)anilino]-4-(1,3-thiazol-2-ylmethylamino)pyridine-3-carboxamide
CID 67502648
6-[4-(azetidin-3-yl)anilino]-4-(benzylamino)pyridine-3-carboxamide
CID 67501790
5-[3-(dimethylcarbamoylamino)piperidin-1-yl]-3-[4-(1-propanoylpiperidin-4-yl)anilino]pyrazine-2-carboxamide
CID 118114616
4-[(2,3-difluorophenyl)methylamino]-6-[4-(1-pyridin-2-ylpiperidin-4-yl)anilino]pyridine-3-carboxamide
CID 67502230
4-[(2,5-difluorophenyl)methylamino]-6-[4-[1-(isocyanomethyl)azetidin-3-yl]anilino]pyridine-3-carboxamide
CID 87664730
6-[4-[1-(cyanomethyl)piperidin-4-yl]anilino]-4-(1H-indol-4-ylmethylamino)pyridine-3-carboxamide
CID 87424144
4-(benzylamino)-6-[4-(4-propan-2-ylpiperazin-1-yl)anilino]pyridine-3-carboxamide
CID 46219366
4-[(2-hydroxy-1-phenylethyl)amino]-6-(4-piperidin-1-ylanilino)pyridine-3-carboxamide
CID 67502011

Frequently Asked Questions

What is the IUPAC name of 4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide?
The IUPAC name of 4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide (CID 67502547) is 4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide.
What is the SMILES notation for 4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide?
The canonical SMILES for 4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide is CCC(=O)N1CCC(c2ccc(Nc3cc(NC(C)C(C)C)c(C(N)=O)cn3)cc2)CC1.
What is the InChIKey of 4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide?
The InChIKey is YYCFHYDLSCYWNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H35N5O2/c1-5-24(31)30-12-10-19(11-13-30)18-6-8-20(9-7-18)29-23-14-22(28-17(4)16(2)3)21(15-27-23)25(26)32/h6-9,14-17,19H,5,10-13H2,1-4H3,(H2,26,32)(H2,27,28,29).
What are the key properties of 4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide?
4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide has a molecular weight of 437.59 g/mol, XLogP of 4.50, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methylbutan-2-ylamino)-6-[4-(1-propanoylpiperidin-4-yl)anilino]pyridine-3-carboxamide is sourced from PubChem (CID 67502547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).