(5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine

C8H8ClN3S — CID 82236048

IUPAC(5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine
SMILESNC(c1ccn[nH]1)c1ccc(Cl)s1
InChIInChI=1S/C8H8ClN3S/c9-7-2-1-6(13-7)8(10)5-3-4-11-12-5/h1-4,8H,10H2,(H,11,12)
InChIKeyHAADLIJMTUQGMC-UHFFFAOYSA-N
MW213.69 g/mol
LogP2.17
Rot. Bonds2

About (5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine

(5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine (PubChem CID 82236048) has the molecular formula C8H8ClN3S and a molecular weight of 213.69 g/mol. Its IUPAC name is (5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine.

Molecular Properties

Compound Name(5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine
PubChem CID82236048
Molecular FormulaC8H8ClN3S
Molecular Weight213.69 g/mol
Exact Mass213.01
IUPAC Name(5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine
SMILESNC(c1ccn[nH]1)c1ccc(Cl)s1
InChIInChI=1S/C8H8ClN3S/c9-7-2-1-6(13-7)8(10)5-3-4-11-12-5/h1-4,8H,10H2,(H,11,12)
InChIKeyHAADLIJMTUQGMC-UHFFFAOYSA-N
XLogP2.17
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.69
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine
CID 103443950
(5-chlorothiophen-2-yl)-(4-methylphenyl)methanamine
CID 43114608
(5-chlorothiophen-2-yl)-(3-methoxypyrazin-2-yl)methanamine
CID 105031917
N-[1-(5-chlorothiophen-2-yl)ethyl]-4-(1H-pyrazol-5-yl)aniline
CID 43733318
(2-chlorothiophen-3-yl)-(5-chlorothiophen-2-yl)methanamine
CID 130700462
1H-pyrazol-5-yl-(2,3,5,6-tetramethylphenyl)methanamine
CID 114990796
(5-chlorothiophen-2-yl)-quinolin-5-ylmethanamine
CID 115604916
(5-chlorothiophen-2-yl)-(1-methyltriazol-4-yl)methanamine
CID 130521639
(5-chlorothiophen-2-yl)-(2,5-dimethylthiophen-3-yl)methanamine
CID 62276867
(5-chlorothiophen-2-yl)-(4-methoxyphenyl)methanamine
CID 43114585
(5-chlorothiophen-2-yl)-(4-methylsulfanylphenyl)methanamine
CID 79214254
(R)-(5-chlorothiophen-2-yl)-piperidin-4-ylmethanamine
CID 95448503

Frequently Asked Questions

What is the IUPAC name of (5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine?
The IUPAC name of (5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine (CID 82236048) is (5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine.
What is the SMILES notation for (5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine?
The canonical SMILES for (5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine is NC(c1ccn[nH]1)c1ccc(Cl)s1.
What is the InChIKey of (5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine?
The InChIKey is HAADLIJMTUQGMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN3S/c9-7-2-1-6(13-7)8(10)5-3-4-11-12-5/h1-4,8H,10H2,(H,11,12).
What are the key properties of (5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine?
(5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine has a molecular weight of 213.69 g/mol, XLogP of 2.17, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chlorothiophen-2-yl)-(1H-pyrazol-5-yl)methanamine is sourced from PubChem (CID 82236048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).