(2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine

C10H13N3S — CID 105155652

IUPAC(2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine
SMILESCc1cc(C(N)c2ccnn2C)cs1
InChIInChI=1S/C10H13N3S/c1-7-5-8(6-14-7)10(11)9-3-4-12-13(9)2/h3-6,10H,11H2,1-2H3
InChIKeyMGMCOMSUESFAER-UHFFFAOYSA-N
MW207.30 g/mol
LogP1.84
Rot. Bonds2

About (2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine

(2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine (PubChem CID 105155652) has the molecular formula C10H13N3S and a molecular weight of 207.30 g/mol. Its IUPAC name is (2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine.

Molecular Properties

Compound Name(2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine
PubChem CID105155652
Molecular FormulaC10H13N3S
Molecular Weight207.30 g/mol
Exact Mass207.08
IUPAC Name(2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine
SMILESCc1cc(C(N)c2ccnn2C)cs1
InChIInChI=1S/C10H13N3S/c1-7-5-8(6-14-7)10(11)9-3-4-12-13(9)2/h3-6,10H,11H2,1-2H3
InChIKeyMGMCOMSUESFAER-UHFFFAOYSA-N
XLogP1.84
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2,6-dimethyl-4-pyridinyl)-(2-methylpyrazol-3-yl)methanamine
CID 107503143
(3,5-difluorophenyl)-(2-methylpyrazol-3-yl)methanamine
CID 63963313
(2-methylpyrazol-3-yl)-(5-methyl-3-pyridinyl)methanamine
CID 105148719
(3-chlorophenyl)-(2-methylpyrazol-3-yl)methanamine
CID 63963062
(5-methylthiophen-3-yl)-(1,3,5-trimethylpyrazol-4-yl)methanamine
CID 105155533
(4-methoxythiophen-2-yl)-(2-methylpyrazol-3-yl)methanamine
CID 115858819
(2-methylpyrazol-3-yl)-(4-methylsulfanylphenyl)methanamine
CID 115858788
(2-methylpyrazol-3-yl)-(4-methylthiadiazol-5-yl)methanamine
CID 105148761
(2-methylpyrazol-3-yl)-(2-methyl-3-pyridinyl)methanamine
CID 105148585
(5-methylthiophen-3-yl)-(4-propan-2-ylphenyl)methanamine
CID 65105067
[3-(2-methylpropyl)phenyl]-(2-methylpyrazol-3-yl)methanamine
CID 105188165
(5-chloro-2-methylphenyl)-(2-methylpyrazol-3-yl)methanamine
CID 115858606

Frequently Asked Questions

What is the IUPAC name of (2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine?
The IUPAC name of (2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine (CID 105155652) is (2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine.
What is the SMILES notation for (2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine?
The canonical SMILES for (2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine is Cc1cc(C(N)c2ccnn2C)cs1.
What is the InChIKey of (2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine?
The InChIKey is MGMCOMSUESFAER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S/c1-7-5-8(6-14-7)10(11)9-3-4-12-13(9)2/h3-6,10H,11H2,1-2H3.
What are the key properties of (2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine?
(2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine has a molecular weight of 207.30 g/mol, XLogP of 1.84, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrazol-3-yl)-(5-methylthiophen-3-yl)methanamine is sourced from PubChem (CID 105155652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).