N-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine

C15H23N7 — CID 56821952

IUPACN-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine
SMILESc1cc2nnnn2nc1NC1CCN(CC2CCCC2)CC1
InChIInChI=1S/C15H23N7/c1-2-4-12(3-1)11-21-9-7-13(8-10-21)16-14-5-6-15-17-19-20-22(15)18-14/h5-6,12-13H,1-4,7-11H2,(H,16,18)
InChIKeyFSECMXLPKQUGCA-UHFFFAOYSA-N
MW301.40 g/mol
LogP1.59
Rot. Bonds4

About N-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine

N-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine (PubChem CID 56821952) has the molecular formula C15H23N7 and a molecular weight of 301.40 g/mol. Its IUPAC name is N-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine.

Molecular Properties

Compound NameN-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine
PubChem CID56821952
Molecular FormulaC15H23N7
Molecular Weight301.40 g/mol
Exact Mass301.20
IUPAC NameN-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine
SMILESc1cc2nnnn2nc1NC1CCN(CC2CCCC2)CC1
InChIInChI=1S/C15H23N7/c1-2-4-12(3-1)11-21-9-7-13(8-10-21)16-14-5-6-15-17-19-20-22(15)18-14/h5-6,12-13H,1-4,7-11H2,(H,16,18)
InChIKeyFSECMXLPKQUGCA-UHFFFAOYSA-N
XLogP1.59
TPSA71.24 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.40
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(oxan-4-yl)tetrazolo[1,5-b]pyridazin-6-amine
CID 112731148
N-[1-[(2-methoxyphenyl)methyl]piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine
CID 56816190
N-(4,4-dimethylcyclohexyl)tetrazolo[1,5-b]pyridazin-6-amine
CID 79033610
N-(1,1-dioxothiolan-3-yl)tetrazolo[1,5-b]pyridazin-6-amine
CID 47136339
N-(3-methylsulfanylcyclohexyl)tetrazolo[1,5-b]pyridazin-6-amine
CID 113237754
6-[3-(azepan-1-ylmethyl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine
CID 71933519
N-(1-cyclopropyl-5-methylpyrrolidin-3-yl)tetrazolo[1,5-b]pyridazin-6-amine
CID 127441909
6-chloro-N-[1-(cyclopentylmethyl)piperidin-4-yl]pyrazin-2-amine
CID 47470211
(1S)-1-cyclohexyl-N,N-dimethyl-N'-(tetrazolo[1,5-b]pyridazin-6-yl)ethane-1,2-diamine
CID 94063941
N-(2,2-dimethylcyclopropyl)tetrazolo[1,5-b]pyridazin-6-amine
CID 78968755
N-[3-(4-methylpiperidin-1-yl)propyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 24590303
N-[1-(cyclopentylmethyl)piperidin-4-yl]-6-ethoxypyrimidin-4-amine
CID 133490645

Frequently Asked Questions

What is the IUPAC name of N-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine?
The IUPAC name of N-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine (CID 56821952) is N-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine.
What is the SMILES notation for N-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine?
The canonical SMILES for N-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine is c1cc2nnnn2nc1NC1CCN(CC2CCCC2)CC1.
What is the InChIKey of N-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine?
The InChIKey is FSECMXLPKQUGCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N7/c1-2-4-12(3-1)11-21-9-7-13(8-10-21)16-14-5-6-15-17-19-20-22(15)18-14/h5-6,12-13H,1-4,7-11H2,(H,16,18).
What are the key properties of N-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine?
N-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine has a molecular weight of 301.40 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(cyclopentylmethyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine is sourced from PubChem (CID 56821952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).