N-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine

C8H15N3 — CID 579620

IUPACN-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine
SMILESCNCc1c(C)nn(C)c1C
InChIInChI=1S/C8H15N3/c1-6-8(5-9-3)7(2)11(4)10-6/h9H,5H2,1-4H3
InChIKeyDBORGGVCQYVMEP-UHFFFAOYSA-N
MW153.23 g/mol
LogP0.76
Rot. Bonds2

About N-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine

N-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine (PubChem CID 579620) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is N-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine
PubChem CID579620
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC NameN-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine
SMILESCNCc1c(C)nn(C)c1C
InChIInChI=1S/C8H15N3/c1-6-8(5-9-3)7(2)11(4)10-6/h9H,5H2,1-4H3
InChIKeyDBORGGVCQYVMEP-UHFFFAOYSA-N
XLogP0.76
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-Dimethyl-1-(1-methylethyl)-1H-pyrazol-4-amine
CID 3031275
1-[(trimethyl-1H-pyrazol-4-yl)methyl]piperazine
CID 6485353
4-ethynyl-1,3,5-trimethyl-1H-pyrazole
CID 12299300
1,3,4,5-Tetramethyl-1H-pyrazole
CID 579642
1-[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]piperazine
CID 7175809
(1,3,5-trimethyl-1H-pyrazol-4-yl)methylamine
CID 2776430
[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl](methyl)amine
CID 7022224
1,3,5-trimethyl-1H-pyrazole-4-carbaldehyde oxime
CID 9559822
3-(trimethyl-1H-pyrazol-4-yl)propan-1-amine
CID 6492154
Sbb010340
CID 6492580
2-(trimethyl-1H-pyrazol-4-yl)acetonitrile
CID 13792877
(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methanamine
CID 16394814

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine?
The IUPAC name of N-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine (CID 579620) is N-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine.
What is the SMILES notation for N-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine?
The canonical SMILES for N-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine is CNCc1c(C)nn(C)c1C.
What is the InChIKey of N-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine?
The InChIKey is DBORGGVCQYVMEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-6-8(5-9-3)7(2)11(4)10-6/h9H,5H2,1-4H3.
What are the key properties of N-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine?
N-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine has a molecular weight of 153.23 g/mol, XLogP of 0.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1,3,5-trimethylpyrazol-4-yl)methanamine is sourced from PubChem (CID 579620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).