3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide

C18H15N5O2 — CID 171645346

IUPAC3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide
SMILESNC(=O)c1nc2cccnc2c(-c2cccc3c2CCN3C=O)c1N
InChIInChI=1S/C18H15N5O2/c19-15-14(11-3-1-5-13-10(11)6-8-23(13)9-24)16-12(4-2-7-21-16)22-17(15)18(20)25/h1-5,7,9H,6,8,19H2,(H2,20,25)
InChIKeyPHRDYPLMKNQPRC-UHFFFAOYSA-N
MW333.35 g/mol
LogP1.50
Rot. Bonds3

About 3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide

3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide (PubChem CID 171645346) has the molecular formula C18H15N5O2 and a molecular weight of 333.35 g/mol. Its IUPAC name is 3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide
PubChem CID171645346
Molecular FormulaC18H15N5O2
Molecular Weight333.35 g/mol
Exact Mass333.12
IUPAC Name3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide
SMILESNC(=O)c1nc2cccnc2c(-c2cccc3c2CCN3C=O)c1N
InChIInChI=1S/C18H15N5O2/c19-15-14(11-3-1-5-13-10(11)6-8-23(13)9-24)16-12(4-2-7-21-16)22-17(15)18(20)25/h1-5,7,9H,6,8,19H2,(H2,20,25)
InChIKeyPHRDYPLMKNQPRC-UHFFFAOYSA-N
XLogP1.50
TPSA115.20 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.35
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-amino-4-(2,3-dihydro-1H-indol-4-yl)-1,5-naphthyridine-2-carboxamide
CID 171645150
3-amino-4-[4-(trifluoromethyl)pyrimidin-5-yl]-1,5-naphthyridine-2-carboxamide
CID 171645092
3-amino-4-(1,4-dimethylpyrazol-5-yl)-1,5-naphthyridine-2-carboxamide
CID 171645050
7-amino-8-(3-hydroxy-2-methylphenyl)quinoline-6-carboxamide
CID 171645303
2-quinolin-8-yl-3,4-dihydropyrazol-5-amine
CID 13195247
4-(2-amino-3-pyridinyl)benzamide
CID 121007996
ethyl 3-amino-4-bromo-1,5-naphthyridine-2-carboxylate
CID 171645238
5-oxo-1-quinolin-8-ylpyrrolidine-3-carboxamide
CID 168698201
5-amino-4-(3-hydroxy-2-methylphenyl)-1,3-dimethylpyrazolo[3,4-b]pyridine-6-carboxamide;formamide
CID 171820136
3-(1H-pyrrol-3-yl)pyridine-2-carboxamide
CID 118165857
3-(2-methylphenyl)pyridine-2-carboxamide
CID 174495640
3-quinolin-8-ylprop-2-enal
CID 73158990

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide?
The IUPAC name of 3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide (CID 171645346) is 3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide.
What is the SMILES notation for 3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide?
The canonical SMILES for 3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide is NC(=O)c1nc2cccnc2c(-c2cccc3c2CCN3C=O)c1N.
What is the InChIKey of 3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide?
The InChIKey is PHRDYPLMKNQPRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O2/c19-15-14(11-3-1-5-13-10(11)6-8-23(13)9-24)16-12(4-2-7-21-16)22-17(15)18(20)25/h1-5,7,9H,6,8,19H2,(H2,20,25).
What are the key properties of 3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide?
3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide has a molecular weight of 333.35 g/mol, XLogP of 1.50, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-(1-formyl-2,3-dihydroindol-4-yl)-1,5-naphthyridine-2-carboxamide is sourced from PubChem (CID 171645346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).