[6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine

C13H18N4S — CID 62915896

IUPAC[6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine
SMILESCc1nc(Cc2cccs2)nc(NN)c1C(C)C
InChIInChI=1S/C13H18N4S/c1-8(2)12-9(3)15-11(16-13(12)17-14)7-10-5-4-6-18-10/h4-6,8H,7,14H2,1-3H3,(H,15,16,17)
InChIKeyUTJSGEFEWHCRKN-UHFFFAOYSA-N
MW262.38 g/mol
LogP2.85
Rot. Bonds4

About [6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine

[6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine (PubChem CID 62915896) has the molecular formula C13H18N4S and a molecular weight of 262.38 g/mol. Its IUPAC name is [6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine.

Molecular Properties

Compound Name[6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine
PubChem CID62915896
Molecular FormulaC13H18N4S
Molecular Weight262.38 g/mol
Exact Mass262.13
IUPAC Name[6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine
SMILESCc1nc(Cc2cccs2)nc(NN)c1C(C)C
InChIInChI=1S/C13H18N4S/c1-8(2)12-9(3)15-11(16-13(12)17-14)7-10-5-4-6-18-10/h4-6,8H,7,14H2,1-3H3,(H,15,16,17)
InChIKeyUTJSGEFEWHCRKN-UHFFFAOYSA-N
XLogP2.85
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-amine
CID 62913456
[6-methyl-2-[(4-methylphenyl)methyl]-5-propan-2-ylpyrimidin-4-yl]hydrazine
CID 62915531
[2-[(4-bromophenyl)methyl]-6-methyl-5-propan-2-ylpyrimidin-4-yl]hydrazine
CID 62913700
[2-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-yl]hydrazine
CID 62502703
[2-(thiophen-2-ylmethyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-yl]hydrazine
CID 63351692
5-bromo-N-ethyl-6-methyl-2-(thiophen-2-ylmethyl)pyrimidin-4-amine
CID 66306673
(1S)-1-[4-methyl-2-(thiophen-2-ylmethyl)pyrimidin-5-yl]ethanamine
CID 94587586
[2-(thiophen-2-ylmethyl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-yl]hydrazine
CID 83201587
5-bromo-6-methyl-N-propyl-2-(thiophen-2-ylmethyl)pyrimidin-4-amine
CID 66304693
4-methyl-2-(thiophen-2-ylmethyl)pyrimidin-5-amine
CID 130483640
5-bromo-4-chloro-6-methyl-2-(thiophen-2-ylmethyl)pyrimidine
CID 66294351
N,5,6-trimethyl-2-(thiophen-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 62502874

Frequently Asked Questions

What is the IUPAC name of [6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine?
The IUPAC name of [6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine (CID 62915896) is [6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine.
What is the SMILES notation for [6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine?
The canonical SMILES for [6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine is Cc1nc(Cc2cccs2)nc(NN)c1C(C)C.
What is the InChIKey of [6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine?
The InChIKey is UTJSGEFEWHCRKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4S/c1-8(2)12-9(3)15-11(16-13(12)17-14)7-10-5-4-6-18-10/h4-6,8H,7,14H2,1-3H3,(H,15,16,17).
What are the key properties of [6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine?
[6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine has a molecular weight of 262.38 g/mol, XLogP of 2.85, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-5-propan-2-yl-2-(thiophen-2-ylmethyl)pyrimidin-4-yl]hydrazine is sourced from PubChem (CID 62915896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).