N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine

C10H13N3S — CID 106577983

IUPACN-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine
SMILESCNc1nccn1Cc1sccc1C
InChIInChI=1S/C10H13N3S/c1-8-3-6-14-9(8)7-13-5-4-12-10(13)11-2/h3-6H,7H2,1-2H3,(H,11,12)
InChIKeyLVZLCMBNHDKEJA-UHFFFAOYSA-N
MW207.30 g/mol
LogP2.34
Rot. Bonds3

About N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine

N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine (PubChem CID 106577983) has the molecular formula C10H13N3S and a molecular weight of 207.30 g/mol. Its IUPAC name is N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine.

Molecular Properties

Compound NameN-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine
PubChem CID106577983
Molecular FormulaC10H13N3S
Molecular Weight207.30 g/mol
Exact Mass207.08
IUPAC NameN-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine
SMILESCNc1nccn1Cc1sccc1C
InChIInChI=1S/C10H13N3S/c1-8-3-6-14-9(8)7-13-5-4-12-10(13)11-2/h3-6H,7H2,1-2H3,(H,11,12)
InChIKeyLVZLCMBNHDKEJA-UHFFFAOYSA-N
XLogP2.34
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-ethoxypropyl)-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine
CID 106578003
1-[(3-bromothiophen-2-yl)methyl]-N-(2-methylpropyl)imidazol-2-amine
CID 106577763
1-[(3-bromothiophen-2-yl)methyl]-N-(2-methoxyethyl)imidazol-2-amine
CID 106577759
N-methyl-1-[(4-methyl-3-pyridinyl)methyl]imidazol-2-amine
CID 106583356
(2R)-1-[2-(3-methylthiophen-2-yl)imidazol-1-yl]butan-2-ol
CID 95126697
1-(2-methylsulfonylethyl)-2-(3-methylthiophen-2-yl)imidazole
CID 56912209
(2S)-1-[2-(3-methylthiophen-2-yl)imidazol-1-yl]butan-2-ol
CID 95126696
N-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine
CID 106567511
[1-[(3-bromothiophen-2-yl)methyl]imidazol-2-yl]methanol
CID 62222283
(4S)-5-[(3-methylthiophen-2-yl)methyl]-4-(1-propylimidazol-2-yl)-1,4,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 95871567
1-[(2-methylphenyl)methyl]-N-phenylimidazol-2-amine
CID 106563124
N-methyl-4-[(2-thiophen-2-ylimidazol-1-yl)methyl]pyridin-2-amine
CID 55075721

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine?
The IUPAC name of N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine (CID 106577983) is N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine.
What is the SMILES notation for N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine?
The canonical SMILES for N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine is CNc1nccn1Cc1sccc1C.
What is the InChIKey of N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine?
The InChIKey is LVZLCMBNHDKEJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S/c1-8-3-6-14-9(8)7-13-5-4-12-10(13)11-2/h3-6H,7H2,1-2H3,(H,11,12).
What are the key properties of N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine?
N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine has a molecular weight of 207.30 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[(3-methylthiophen-2-yl)methyl]imidazol-2-amine is sourced from PubChem (CID 106577983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).