N-methyl-1-(1-propylpyrazol-3-yl)methanamine

C8H15N3 — CID 19620904

IUPACN-methyl-1-(1-propylpyrazol-3-yl)methanamine
SMILESCCCn1ccc(CNC)n1
InChIInChI=1S/C8H15N3/c1-3-5-11-6-4-8(10-11)7-9-2/h4,6,9H,3,5,7H2,1-2H3
InChIKeyLITWSGCCWNIWON-UHFFFAOYSA-N
MW153.23 g/mol
LogP1.01
Rot. Bonds4

About N-methyl-1-(1-propylpyrazol-3-yl)methanamine

N-methyl-1-(1-propylpyrazol-3-yl)methanamine (PubChem CID 19620904) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is N-methyl-1-(1-propylpyrazol-3-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(1-propylpyrazol-3-yl)methanamine
PubChem CID19620904
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC NameN-methyl-1-(1-propylpyrazol-3-yl)methanamine
SMILESCCCn1ccc(CNC)n1
InChIInChI=1S/C8H15N3/c1-3-5-11-6-4-8(10-11)7-9-2/h4,6,9H,3,5,7H2,1-2H3
InChIKeyLITWSGCCWNIWON-UHFFFAOYSA-N
XLogP1.01
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1-propylpyrazol-3-yl)methanamine
CID 19576818
2-methyl-N-[(1-propylpyrazol-3-yl)methyl]propan-1-amine;hydrochloride
CID 126968063
3-(bromomethyl)-1-propylpyrazole
CID 122165667
3-(bromomethyl)-1-propylpyrazole;hydrobromide
CID 126965597
3-butyl-1-propylpyrazole
CID 90936272
3-(methoxymethyl)-1-propylpyrazole
CID 66016916
N-methyl-1-[1-(2,2,2-trifluoroethyl)pyrazol-3-yl]methanamine;hydrochloride
CID 132770062
N-[(2,5-dimethylpyrazol-3-yl)methyl]-1-(1-propylpyrazol-3-yl)methanamine;hydrochloride
CID 126965948
N-[(1-ethylpyrazol-4-yl)methyl]-1-(1-propylpyrazol-3-yl)methanamine;hydrochloride
CID 126966967
3-(propan-2-yloxymethyl)-1-propylpyrazole
CID 122170479
4-[[(1-propylpyrazol-3-yl)methylamino]methyl]benzene-1,3-diol;hydrochloride
CID 126964545
3-(butan-2-yloxymethyl)-1-propylpyrazole
CID 122170516

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-propylpyrazol-3-yl)methanamine?
The IUPAC name of N-methyl-1-(1-propylpyrazol-3-yl)methanamine (CID 19620904) is N-methyl-1-(1-propylpyrazol-3-yl)methanamine.
What is the SMILES notation for N-methyl-1-(1-propylpyrazol-3-yl)methanamine?
The canonical SMILES for N-methyl-1-(1-propylpyrazol-3-yl)methanamine is CCCn1ccc(CNC)n1.
What is the InChIKey of N-methyl-1-(1-propylpyrazol-3-yl)methanamine?
The InChIKey is LITWSGCCWNIWON-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-3-5-11-6-4-8(10-11)7-9-2/h4,6,9H,3,5,7H2,1-2H3.
What are the key properties of N-methyl-1-(1-propylpyrazol-3-yl)methanamine?
N-methyl-1-(1-propylpyrazol-3-yl)methanamine has a molecular weight of 153.23 g/mol, XLogP of 1.01, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-propylpyrazol-3-yl)methanamine is sourced from PubChem (CID 19620904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).