N-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine

C15H23N3 — CID 103126570

IUPACN-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine
SMILESCCCCCCC(NC)c1cnn2ccccc12
InChIInChI=1S/C15H23N3/c1-3-4-5-6-9-14(16-2)13-12-17-18-11-8-7-10-15(13)18/h7-8,10-12,14,16H,3-6,9H2,1-2H3
InChIKeyYOTJFYPSNZVTRF-UHFFFAOYSA-N
MW245.37 g/mol
LogP3.57
Rot. Bonds7

About N-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine

N-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine (PubChem CID 103126570) has the molecular formula C15H23N3 and a molecular weight of 245.37 g/mol. Its IUPAC name is N-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine.

Molecular Properties

Compound NameN-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine
PubChem CID103126570
Molecular FormulaC15H23N3
Molecular Weight245.37 g/mol
Exact Mass245.19
IUPAC NameN-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine
SMILESCCCCCCC(NC)c1cnn2ccccc12
InChIInChI=1S/C15H23N3/c1-3-4-5-6-9-14(16-2)13-12-17-18-11-8-7-10-15(13)18/h7-8,10-12,14,16H,3-6,9H2,1-2H3
InChIKeyYOTJFYPSNZVTRF-UHFFFAOYSA-N
XLogP3.57
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine?
The IUPAC name of N-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine (CID 103126570) is N-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine.
What is the SMILES notation for N-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine?
The canonical SMILES for N-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine is CCCCCCC(NC)c1cnn2ccccc12.
What is the InChIKey of N-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine?
The InChIKey is YOTJFYPSNZVTRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3/c1-3-4-5-6-9-14(16-2)13-12-17-18-11-8-7-10-15(13)18/h7-8,10-12,14,16H,3-6,9H2,1-2H3.
What are the key properties of N-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine?
N-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine has a molecular weight of 245.37 g/mol, XLogP of 3.57, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-pyrazolo[1,5-a]pyridin-3-ylheptan-1-amine is sourced from PubChem (CID 103126570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).