N,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine

C20H21N5 — CID 170752830

IUPACN,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine
SMILESc1cc2cc(CN(Cc3ccn4nccc4c3)C3CCC3)ccn2n1
InChIInChI=1S/C20H21N5/c1-2-18(3-1)23(14-16-6-10-24-19(12-16)4-8-21-24)15-17-7-11-25-20(13-17)5-9-22-25/h4-13,18H,1-3,14-15H2
InChIKeyNLSABCUXEDCESM-UHFFFAOYSA-N
MW331.42 g/mol
LogP3.54
Rot. Bonds5

About N,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine

N,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine (PubChem CID 170752830) has the molecular formula C20H21N5 and a molecular weight of 331.42 g/mol. Its IUPAC name is N,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine.

Molecular Properties

Compound NameN,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine
PubChem CID170752830
Molecular FormulaC20H21N5
Molecular Weight331.42 g/mol
Exact Mass331.18
IUPAC NameN,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine
SMILESc1cc2cc(CN(Cc3ccn4nccc4c3)C3CCC3)ccn2n1
InChIInChI=1S/C20H21N5/c1-2-18(3-1)23(14-16-6-10-24-19(12-16)4-8-21-24)15-17-7-11-25-20(13-17)5-9-22-25/h4-13,18H,1-3,14-15H2
InChIKeyNLSABCUXEDCESM-UHFFFAOYSA-N
XLogP3.54
TPSA37.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 53.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-pyrazolo[1,5-a]pyridin-5-ylethanol
CID 59476221
5-(2-methylpropyl)pyrazolo[1,5-a]pyridine
CID 146215810
N,N-dibenzylcyclobutanamine
CID 70822586
5-[[4-(2-methoxyethyl)piperidin-1-yl]methyl]pyrazolo[1,5-a]pyridine
CID 138808692
4-[[cyclopropyl-[(4-pyrazol-1-ylphenyl)methyl]amino]methyl]-2-methoxyphenol
CID 75504406
N-(2-chloroethyl)-N-[(3-chlorophenyl)methyl]cyclopentanamine
CID 63389670
N-pyrazolo[1,5-a]pyridin-5-ylcyclopentanecarboxamide
CID 86266818
N-benzyl-N-(pyridin-2-ylmethyl)cyclohexanamine
CID 71881409
N-(furan-3-ylmethyl)-N-[(1-methylimidazol-2-yl)methyl]cyclohexanamine
CID 122158285
N-(2-chloroethyl)-N-[(3,4-dimethylphenyl)methyl]cyclobutanamine
CID 102861334
N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-phenyl-1,2-oxazol-5-yl)methyl]cyclopentanamine
CID 30588730
N-(pyrazolo[1,5-a]pyridin-5-ylmethylidene)hydroxylamine
CID 144840717

Frequently Asked Questions

What is the IUPAC name of N,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine?
The IUPAC name of N,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine (CID 170752830) is N,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine.
What is the SMILES notation for N,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine?
The canonical SMILES for N,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine is c1cc2cc(CN(Cc3ccn4nccc4c3)C3CCC3)ccn2n1.
What is the InChIKey of N,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine?
The InChIKey is NLSABCUXEDCESM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5/c1-2-18(3-1)23(14-16-6-10-24-19(12-16)4-8-21-24)15-17-7-11-25-20(13-17)5-9-22-25/h4-13,18H,1-3,14-15H2.
What are the key properties of N,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine?
N,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine has a molecular weight of 331.42 g/mol, XLogP of 3.54, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(pyrazolo[1,5-a]pyridin-5-ylmethyl)cyclobutanamine is sourced from PubChem (CID 170752830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).