N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide

C19H22N4O2 — CID 84574667

IUPACN-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
SMILESCC1Cc2ccccc2N1c1ncccc1C(=O)NCCCNC=O
InChIInChI=1S/C19H22N4O2/c1-14-12-15-6-2-3-8-17(15)23(14)18-16(7-4-10-21-18)19(25)22-11-5-9-20-13-24/h2-4,6-8,10,13-14H,5,9,11-12H2,1H3,(H,20,24)(H,22,25)
InChIKeyUBAIINGCSSEBJO-UHFFFAOYSA-N
MW338.41 g/mol
LogP2.03
Rot. Bonds7

About N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide

N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide (PubChem CID 84574667) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
PubChem CID84574667
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC NameN-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
SMILESCC1Cc2ccccc2N1c1ncccc1C(=O)NCCCNC=O
InChIInChI=1S/C19H22N4O2/c1-14-12-15-6-2-3-8-17(15)23(14)18-16(7-4-10-21-18)19(25)22-11-5-9-20-13-24/h2-4,6-8,10,13-14H,5,9,11-12H2,1H3,(H,20,24)(H,22,25)
InChIKeyUBAIINGCSSEBJO-UHFFFAOYSA-N
XLogP2.03
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide (CID 84574667) is N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide is CC1Cc2ccccc2N1c1ncccc1C(=O)NCCCNC=O.
What is the InChIKey of N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
The InChIKey is UBAIINGCSSEBJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-14-12-15-6-2-3-8-17(15)23(14)18-16(7-4-10-21-18)19(25)22-11-5-9-20-13-24/h2-4,6-8,10,13-14H,5,9,11-12H2,1H3,(H,20,24)(H,22,25).
What are the key properties of N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide?
N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 2.03, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-formamidopropyl)-2-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 84574667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).