N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide

C20H19N5O — CID 91949000

IUPACN-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide
SMILESCc1ccc2cnn(CCCNC(=O)c3cncc4cccnc34)c2c1
InChIInChI=1S/C20H19N5O/c1-14-5-6-15-12-24-25(18(15)10-14)9-3-8-23-20(26)17-13-21-11-16-4-2-7-22-19(16)17/h2,4-7,10-13H,3,8-9H2,1H3,(H,23,26)
InChIKeyZNMYHPZQZLUSFU-UHFFFAOYSA-N
MW345.41 g/mol
LogP3.11
Rot. Bonds5

About N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide

N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide (PubChem CID 91949000) has the molecular formula C20H19N5O and a molecular weight of 345.41 g/mol. Its IUPAC name is N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide.

Molecular Properties

Compound NameN-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide
PubChem CID91949000
Molecular FormulaC20H19N5O
Molecular Weight345.41 g/mol
Exact Mass345.16
IUPAC NameN-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide
SMILESCc1ccc2cnn(CCCNC(=O)c3cncc4cccnc34)c2c1
InChIInChI=1S/C20H19N5O/c1-14-5-6-15-12-24-25(18(15)10-14)9-3-8-23-20(26)17-13-21-11-16-4-2-7-22-19(16)17/h2,4-7,10-13H,3,8-9H2,1H3,(H,23,26)
InChIKeyZNMYHPZQZLUSFU-UHFFFAOYSA-N
XLogP3.11
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.41
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridin-8-amine
CID 91953375
2-methyl-N-[3-(6-methylindazol-1-yl)propyl]pyrazole-3-carboxamide
CID 71688492
N-(3-morpholin-4-ylpropyl)-1,6-naphthyridine-8-carboxamide
CID 91949073
N-(2-methylpropyl)-1,6-naphthyridine-8-carboxamide
CID 91949075
N-(2-morpholin-4-ylethyl)-1,6-naphthyridine-8-carboxamide
CID 91949050
3,6-dimethyl-N-[3-(6-methylindazol-1-yl)propyl]-4-oxofuro[2,3-d]pyrimidine-5-carboxamide
CID 91949873
N-(3-methoxypropyl)-2-(6-methylindazol-1-yl)acetamide
CID 22509905
1-(3-methoxypropyl)-6-methylindazole
CID 66596206
N-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-1,6-naphthyridine-8-carboxamide
CID 91949032
2-(6-methylindazol-1-yl)-N-(3-phenylpropyl)acetamide
CID 22509817
N-[3-(6-methylindazol-1-yl)propyl]-5-oxo-1,4-thiazepane-3-carboxamide
CID 102552029
2-[2-(6-methylindazol-1-yl)ethylamino]ethanol
CID 129023158

Frequently Asked Questions

What is the IUPAC name of N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide?
The IUPAC name of N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide (CID 91949000) is N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide.
What is the SMILES notation for N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide?
The canonical SMILES for N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide is Cc1ccc2cnn(CCCNC(=O)c3cncc4cccnc34)c2c1.
What is the InChIKey of N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide?
The InChIKey is ZNMYHPZQZLUSFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O/c1-14-5-6-15-12-24-25(18(15)10-14)9-3-8-23-20(26)17-13-21-11-16-4-2-7-22-19(16)17/h2,4-7,10-13H,3,8-9H2,1H3,(H,23,26).
What are the key properties of N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide?
N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide has a molecular weight of 345.41 g/mol, XLogP of 3.11, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(6-methylindazol-1-yl)propyl]-1,6-naphthyridine-8-carboxamide is sourced from PubChem (CID 91949000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).