N-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine

C14H22N4O — CID 103117705

IUPACN-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine
SMILESCOCCNCCCNCc1cnn2ccccc12
InChIInChI=1S/C14H22N4O/c1-19-10-8-15-6-4-7-16-11-13-12-17-18-9-3-2-5-14(13)18/h2-3,5,9,12,15-16H,4,6-8,10-11H2,1H3
InChIKeyLHHKSWIFEVELHT-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.05
Rot. Bonds9

About N-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine

N-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine (PubChem CID 103117705) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine
PubChem CID103117705
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC NameN-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine
SMILESCOCCNCCCNCc1cnn2ccccc12
InChIInChI=1S/C14H22N4O/c1-19-10-8-15-6-4-7-16-11-13-12-17-18-9-3-2-5-14(13)18/h2-3,5,9,12,15-16H,4,6-8,10-11H2,1H3
InChIKeyLHHKSWIFEVELHT-UHFFFAOYSA-N
XLogP1.05
TPSA50.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-(2-methoxyethoxy)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)butan-1-amine
CID 115614347
N-(2-methoxyethyl)-3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)propanamide
CID 115614291
N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)hexan-1-amine
CID 63311788
N',N'-diethyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine
CID 63311956
2-methylsulfinyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)ethanamine
CID 115632462
2,3-dimethoxy-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propan-1-amine
CID 113368892
N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)pent-3-yn-1-amine
CID 116642881
3-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)propanamide
CID 63311707
2-(methoxymethyl)-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)aniline
CID 63312144
N'-[(2-fluorophenyl)methyl]-N-(2-methoxyethyl)propane-1,3-diamine
CID 113410575
2-(pyrazolo[1,5-a]pyridin-3-ylmethylamino)acetic acid
CID 63311880
2-methylsulfanyl-N-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propan-1-amine
CID 115757570

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine?
The IUPAC name of N-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine (CID 103117705) is N-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine.
What is the SMILES notation for N-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine?
The canonical SMILES for N-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine is COCCNCCCNCc1cnn2ccccc12.
What is the InChIKey of N-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine?
The InChIKey is LHHKSWIFEVELHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-19-10-8-15-6-4-7-16-11-13-12-17-18-9-3-2-5-14(13)18/h2-3,5,9,12,15-16H,4,6-8,10-11H2,1H3.
What are the key properties of N-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine?
N-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine has a molecular weight of 262.36 g/mol, XLogP of 1.05, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N'-(pyrazolo[1,5-a]pyridin-3-ylmethyl)propane-1,3-diamine is sourced from PubChem (CID 103117705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).