N-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine

C10H13N3S — CID 66150778

IUPACN-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine
SMILESCNCc1cncn1Cc1ccsc1
InChIInChI=1S/C10H13N3S/c1-11-4-10-5-12-8-13(10)6-9-2-3-14-7-9/h2-3,5,7-8,11H,4,6H2,1H3
InChIKeyGESNKFMHWIEPNM-UHFFFAOYSA-N
MW207.30 g/mol
LogP1.71
Rot. Bonds4

About N-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine

N-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine (PubChem CID 66150778) has the molecular formula C10H13N3S and a molecular weight of 207.30 g/mol. Its IUPAC name is N-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine
PubChem CID66150778
Molecular FormulaC10H13N3S
Molecular Weight207.30 g/mol
Exact Mass207.08
IUPAC NameN-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine
SMILESCNCc1cncn1Cc1ccsc1
InChIInChI=1S/C10H13N3S/c1-11-4-10-5-12-8-13(10)6-9-2-3-14-7-9/h2-3,5,7-8,11H,4,6H2,1H3
InChIKeyGESNKFMHWIEPNM-UHFFFAOYSA-N
XLogP1.71
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[3-(thiophen-3-ylmethyl)imidazol-4-yl]methyl]propan-2-amine
CID 66150573
1-methyl-5-(thiophen-3-ylmethyl)imidazole
CID 59037611
3-(thiophen-3-ylmethyl)imidazole-4-carbaldehyde
CID 66146798
N-methyl-1-[3-[(4-methyl-3-pyridinyl)methyl]imidazol-4-yl]methanamine
CID 114957819
N-methyl-1-[3-(pyridin-2-ylmethyl)imidazol-4-yl]methanamine
CID 66147540
1-[3,5-dimethyl-1-(thiophen-3-ylmethyl)pyrazol-4-yl]-N-methylmethanamine
CID 43647714
1-[3-[(2,4-dimethoxyphenyl)methyl]imidazol-4-yl]-N-methylmethanamine
CID 66149526
N-[[3-[(4-chlorophenyl)methyl]imidazol-4-yl]methyl]-2-methylpropan-1-amine
CID 66147520
1-[3-(2,2-dimethylbutyl)imidazol-4-yl]-N-methylmethanamine
CID 103466374
tert-butyl N-[(1R)-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]ethyl]carbamate
CID 114986293
2-methyl-N-[[3-(1-thiophen-3-ylpropan-2-yl)imidazol-4-yl]methyl]propan-1-amine
CID 66146542
5-methyl-1-[(4-thiophen-3-ylphenyl)methyl]imidazole
CID 70288831

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine?
The IUPAC name of N-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine (CID 66150778) is N-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine.
What is the SMILES notation for N-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine?
The canonical SMILES for N-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine is CNCc1cncn1Cc1ccsc1.
What is the InChIKey of N-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine?
The InChIKey is GESNKFMHWIEPNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S/c1-11-4-10-5-12-8-13(10)6-9-2-3-14-7-9/h2-3,5,7-8,11H,4,6H2,1H3.
What are the key properties of N-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine?
N-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine has a molecular weight of 207.30 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[3-(thiophen-3-ylmethyl)imidazol-4-yl]methanamine is sourced from PubChem (CID 66150778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).