2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide

C24H21N5O2 — CID 141452976

IUPAC2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide
SMILESCn1c(-c2ccncc2NC(=O)c2ccnc(C(=O)NC3CC3)c2)cc2ccccc21
InChIInChI=1S/C24H21N5O2/c1-29-21-5-3-2-4-15(21)13-22(29)18-9-10-25-14-20(18)28-23(30)16-8-11-26-19(12-16)24(31)27-17-6-7-17/h2-5,8-14,17H,6-7H2,1H3,(H,27,31)(H,28,30)
InChIKeyIVXVRIXBLZVICZ-UHFFFAOYSA-N
MW411.47 g/mol
LogP3.78
Rot. Bonds5

About 2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide

2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide (PubChem CID 141452976) has the molecular formula C24H21N5O2 and a molecular weight of 411.47 g/mol. Its IUPAC name is 2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide
PubChem CID141452976
Molecular FormulaC24H21N5O2
Molecular Weight411.47 g/mol
Exact Mass411.17
IUPAC Name2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide
SMILESCn1c(-c2ccncc2NC(=O)c2ccnc(C(=O)NC3CC3)c2)cc2ccccc21
InChIInChI=1S/C24H21N5O2/c1-29-21-5-3-2-4-15(21)13-22(29)18-9-10-25-14-20(18)28-23(30)16-8-11-26-19(12-16)24(31)27-17-6-7-17/h2-5,8-14,17H,6-7H2,1H3,(H,27,31)(H,28,30)
InChIKeyIVXVRIXBLZVICZ-UHFFFAOYSA-N
XLogP3.78
TPSA88.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.47
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-(3-chlorocyclobutyl)-4-N-(4-phenyl-3-pyridinyl)pyridine-2,4-dicarboxamide
CID 141452842
2-N-cycloheptyl-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109089442
2-N-cyclohexyl-4-N-(2-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109081583
2-N-cyclopropyl-4-N-([1,3]thiazolo[4,5-c]pyridin-2-yl)pyridine-2,4-dicarboxamide
CID 141452988
2-N-cyclopropyl-4-N-[6-(2-fluorophenyl)pyrazin-2-yl]pyridine-2,4-dicarboxamide
CID 141452902
4-N-(5-chloro-2-methylphenyl)-2-N-cyclopropylpyridine-2,4-dicarboxamide
CID 109078715
4-N-(2-tert-butylphenyl)-2-N-cyclohexylpyridine-2,4-dicarboxamide
CID 109081588
2-N-cyclopropyl-4-N-(2-morpholin-4-ylphenyl)pyridine-2,4-dicarboxamide
CID 109078752
methyl 2-[[2-(cycloheptylcarbamoyl)pyridine-4-carbonyl]amino]benzoate
CID 109089488
2-N-cyclopropyl-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109078757
4-N-(4-chloro-2-methylphenyl)-2-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080960
2-N-cyclopropyl-4-N-(2-methyl-1,3-thiazol-5-yl)pyridine-2,4-dicarboxamide
CID 141452975

Frequently Asked Questions

What is the IUPAC name of 2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide (CID 141452976) is 2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide is Cn1c(-c2ccncc2NC(=O)c2ccnc(C(=O)NC3CC3)c2)cc2ccccc21.
What is the InChIKey of 2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide?
The InChIKey is IVXVRIXBLZVICZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N5O2/c1-29-21-5-3-2-4-15(21)13-22(29)18-9-10-25-14-20(18)28-23(30)16-8-11-26-19(12-16)24(31)27-17-6-7-17/h2-5,8-14,17H,6-7H2,1H3,(H,27,31)(H,28,30).
What are the key properties of 2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide?
2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide has a molecular weight of 411.47 g/mol, XLogP of 3.78, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-cyclopropyl-4-N-[4-(1-methylindol-2-yl)-3-pyridinyl]pyridine-2,4-dicarboxamide is sourced from PubChem (CID 141452976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).