3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine

C10H14N4S — CID 103011577

IUPAC3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine
SMILESCn1cc(CCC(N)c2cncs2)cn1
InChIInChI=1S/C10H14N4S/c1-14-6-8(4-13-14)2-3-9(11)10-5-12-7-15-10/h4-7,9H,2-3,11H2,1H3
InChIKeyBJINFPIZWHJYOM-UHFFFAOYSA-N
MW222.32 g/mol
LogP1.51
Rot. Bonds4

About 3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine

3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine (PubChem CID 103011577) has the molecular formula C10H14N4S and a molecular weight of 222.32 g/mol. Its IUPAC name is 3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine.

Molecular Properties

Compound Name3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine
PubChem CID103011577
Molecular FormulaC10H14N4S
Molecular Weight222.32 g/mol
Exact Mass222.09
IUPAC Name3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine
SMILESCn1cc(CCC(N)c2cncs2)cn1
InChIInChI=1S/C10H14N4S/c1-14-6-8(4-13-14)2-3-9(11)10-5-12-7-15-10/h4-7,9H,2-3,11H2,1H3
InChIKeyBJINFPIZWHJYOM-UHFFFAOYSA-N
XLogP1.51
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.32
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(5-ethylthiophen-2-yl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103029878
3-(1-methylpyrazol-4-yl)-1-(4-methylthiadiazol-5-yl)propan-1-amine
CID 103029778
1-(1-benzothiophen-2-yl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103030201
3-(1-methylpyrazol-4-yl)-1-(thiadiazol-4-yl)propan-1-amine
CID 103030073
1-(2-fluoro-3-methylphenyl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103030310
1-(4-methoxyphenyl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103008702
3-(1-methylpyrazol-4-yl)-1-(4-methylsulfanylphenyl)propan-1-amine
CID 103030188
1-(1H-imidazol-2-yl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103011534
1-(2-bromophenyl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103009628
1-(1,3-thiazol-5-yl)propan-1-amine
CID 67336934
ethyl 2-amino-4-(1-methylpyrazol-4-yl)butanoate
CID 103002910
1-(2,5-dimethylphenyl)-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103030043

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine?
The IUPAC name of 3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine (CID 103011577) is 3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine.
What is the SMILES notation for 3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine?
The canonical SMILES for 3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine is Cn1cc(CCC(N)c2cncs2)cn1.
What is the InChIKey of 3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine?
The InChIKey is BJINFPIZWHJYOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4S/c1-14-6-8(4-13-14)2-3-9(11)10-5-12-7-15-10/h4-7,9H,2-3,11H2,1H3.
What are the key properties of 3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine?
3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine has a molecular weight of 222.32 g/mol, XLogP of 1.51, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpyrazol-4-yl)-1-(1,3-thiazol-5-yl)propan-1-amine is sourced from PubChem (CID 103011577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).