N-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine

C14H21N3OS — CID 106567535

IUPACN-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine
SMILESCOCC(C)Nc1nc(C)cn1CCc1ccsc1
InChIInChI=1S/C14H21N3OS/c1-11-8-17(6-4-13-5-7-19-10-13)14(15-11)16-12(2)9-18-3/h5,7-8,10,12H,4,6,9H2,1-3H3,(H,15,16)
InChIKeyAUKWOXXRWYOPCG-UHFFFAOYSA-N
MW279.41 g/mol
LogP2.94
Rot. Bonds7

About N-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine

N-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine (PubChem CID 106567535) has the molecular formula C14H21N3OS and a molecular weight of 279.41 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine
PubChem CID106567535
Molecular FormulaC14H21N3OS
Molecular Weight279.41 g/mol
Exact Mass279.14
IUPAC NameN-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine
SMILESCOCC(C)Nc1nc(C)cn1CCc1ccsc1
InChIInChI=1S/C14H21N3OS/c1-11-8-17(6-4-13-5-7-19-10-13)14(15-11)16-12(2)9-18-3/h5,7-8,10,12H,4,6,9H2,1-3H3,(H,15,16)
InChIKeyAUKWOXXRWYOPCG-UHFFFAOYSA-N
XLogP2.94
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.41
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-methoxypropan-2-yl)-4-methyl-1-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
CID 106571808
N-(1-methoxypropan-2-yl)-4-methyl-1-(1-thiophen-3-ylethyl)imidazol-2-amine
CID 106570907
1-(2-methoxyethyl)-4-methyl-N-(thiophen-3-ylmethyl)imidazol-2-amine
CID 106571951
1-[(4-fluorophenyl)methyl]-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106558864
N-(1-methoxypropan-2-yl)-4-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]imidazol-2-amine
CID 106566093
1-[(2-ethylphenyl)methyl]-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106574539
N-(1-methoxypropan-2-yl)-4-methyl-1-(2-methylsulfinylpropyl)imidazol-2-amine
CID 106581065
N-(1-methoxypropan-2-yl)-4-methyl-1-propan-2-ylimidazol-2-amine
CID 106554828
1-(2,2-dimethylbutyl)-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106583486
1-[(4,5-dimethylthiophen-2-yl)methyl]-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106573869
1-(2-methoxyethyl)-4-methyl-N-(1-methylsulfanylpropan-2-yl)imidazol-2-amine
CID 106581332
4-methyl-1-propyl-N-(1-thiophen-3-ylethyl)imidazol-2-amine
CID 106570913

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine?
The IUPAC name of N-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine (CID 106567535) is N-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine?
The canonical SMILES for N-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine is COCC(C)Nc1nc(C)cn1CCc1ccsc1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine?
The InChIKey is AUKWOXXRWYOPCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3OS/c1-11-8-17(6-4-13-5-7-19-10-13)14(15-11)16-12(2)9-18-3/h5,7-8,10,12H,4,6,9H2,1-3H3,(H,15,16).
What are the key properties of N-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine?
N-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine has a molecular weight of 279.41 g/mol, XLogP of 2.94, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-4-methyl-1-(2-thiophen-3-ylethyl)imidazol-2-amine is sourced from PubChem (CID 106567535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).