1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine

C8H14N4 — CID 165458737

IUPAC1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine
SMILESCNCc1cc(C2CNC2)n[nH]1
InChIInChI=1S/C8H14N4/c1-9-5-7-2-8(12-11-7)6-3-10-4-6/h2,6,9-10H,3-5H2,1H3,(H,11,12)
InChIKeyGSEPEQFSFLNZMC-UHFFFAOYSA-N
MW166.23 g/mol
LogP-0.18
Rot. Bonds3

About 1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine

1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine (PubChem CID 165458737) has the molecular formula C8H14N4 and a molecular weight of 166.23 g/mol. Its IUPAC name is 1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine
PubChem CID165458737
Molecular FormulaC8H14N4
Molecular Weight166.23 g/mol
Exact Mass166.12
IUPAC Name1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine
SMILESCNCc1cc(C2CNC2)n[nH]1
InChIInChI=1S/C8H14N4/c1-9-5-7-2-8(12-11-7)6-3-10-4-6/h2,6,9-10H,3-5H2,1H3,(H,11,12)
InChIKeyGSEPEQFSFLNZMC-UHFFFAOYSA-N
XLogP-0.18
TPSA52.74 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 5-0.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-cyclobutyl-1H-pyrazol-5-yl)methyl]acetamide
CID 157037255
N-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]-2-methylpropanamide
CID 171523613
(2S)-2-N-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]propane-1,2-diamine
CID 104867760
4-[5-(methoxymethyl)-1H-pyrazol-3-yl]piperidine
CID 90920394
acetic acid;N-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]-6-azaspiro[2.5]octane-2-carboxamide
CID 154888133
1-[3-(3-fluorophenyl)-1H-pyrazol-5-yl]-N-methylmethanamine
CID 62111510
N-methyl-1-[3-(3-methylthiophen-2-yl)-1H-pyrazol-5-yl]methanamine
CID 63990913
N-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]-1-(1-ethylpyrazol-3-yl)methanamine
CID 19627646
(1S)-N-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]-2,2-dimethyl-1-(4-methylphenyl)cyclopropane-1-carboxamide
CID 126430951
N-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]-3-(3,4,5-trimethylpyrazol-1-yl)propanamide
CID 46963475
N-[(3-cyclopropyl-1H-pyrazol-5-yl)methyl]-2,2-dimethyl-1-(4-methylphenyl)cyclopropane-1-carboxamide
CID 119062704
1-[3-(4-bromo-2-chlorophenyl)-1H-pyrazol-5-yl]-N-methylmethanamine
CID 82779069

Frequently Asked Questions

What is the IUPAC name of 1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine?
The IUPAC name of 1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine (CID 165458737) is 1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine?
The canonical SMILES for 1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine is CNCc1cc(C2CNC2)n[nH]1.
What is the InChIKey of 1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine?
The InChIKey is GSEPEQFSFLNZMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4/c1-9-5-7-2-8(12-11-7)6-3-10-4-6/h2,6,9-10H,3-5H2,1H3,(H,11,12).
What are the key properties of 1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine?
1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine has a molecular weight of 166.23 g/mol, XLogP of -0.18, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(azetidin-3-yl)-1H-pyrazol-5-yl]-N-methylmethanamine is sourced from PubChem (CID 165458737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).