4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine

C16H25N3S — CID 106565325

IUPAC4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine
SMILESCCCC(c1cccs1)n1cc(C)nc1NCC(C)C
InChIInChI=1S/C16H25N3S/c1-5-7-14(15-8-6-9-20-15)19-11-13(4)18-16(19)17-10-12(2)3/h6,8-9,11-12,14H,5,7,10H2,1-4H3,(H,17,18)
InChIKeyQLBMPLZLNULIHE-UHFFFAOYSA-N
MW291.46 g/mol
LogP4.71
Rot. Bonds7

About 4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine

4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine (PubChem CID 106565325) has the molecular formula C16H25N3S and a molecular weight of 291.46 g/mol. Its IUPAC name is 4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine.

Molecular Properties

Compound Name4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine
PubChem CID106565325
Molecular FormulaC16H25N3S
Molecular Weight291.46 g/mol
Exact Mass291.18
IUPAC Name4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine
SMILESCCCC(c1cccs1)n1cc(C)nc1NCC(C)C
InChIInChI=1S/C16H25N3S/c1-5-7-14(15-8-6-9-20-15)19-11-13(4)18-16(19)17-10-12(2)3/h6,8-9,11-12,14H,5,7,10H2,1-4H3,(H,17,18)
InChIKeyQLBMPLZLNULIHE-UHFFFAOYSA-N
XLogP4.71
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.46
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-ethoxypropyl)-4-methyl-1-(1-thiophen-2-ylpropyl)imidazol-2-amine
CID 106564369
2-methyl-N-[[3-(1-thiophen-2-ylbutyl)imidazol-4-yl]methyl]propan-1-amine
CID 66149673
4-methyl-1-propyl-N-(1-thiophen-2-ylbutyl)imidazol-2-amine
CID 106565322
1-[4-(dimethylamino)butan-2-yl]-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106567753
1-[1-(4-chlorophenyl)ethyl]-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106565811
1-ethyl-4-methyl-N-(2-methylpropyl)imidazol-2-amine
CID 106554987
2-methyl-N-[1-[1-(1-thiophen-2-ylbutyl)tetrazol-5-yl]ethyl]propan-1-amine
CID 103085714
4-methyl-N-(2-methylpropyl)-1-phenylimidazol-2-amine
CID 106554707
4-methyl-1-propan-2-yl-N-(1-thiophen-2-ylpropan-2-yl)imidazol-2-amine
CID 106573480
7-methyl-3-(1-thiophen-2-ylbutyl)imidazo[4,5-b]pyridin-2-amine
CID 79288597
N-ethyl-4-methyl-1-[1-(1,3-thiazol-2-yl)ethyl]imidazol-2-amine
CID 106574743
3-chloro-5-propyl-4-(1-thiophen-2-ylbutyl)-1,2,4-triazole
CID 63385271

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine?
The IUPAC name of 4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine (CID 106565325) is 4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine.
What is the SMILES notation for 4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine?
The canonical SMILES for 4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine is CCCC(c1cccs1)n1cc(C)nc1NCC(C)C.
What is the InChIKey of 4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine?
The InChIKey is QLBMPLZLNULIHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3S/c1-5-7-14(15-8-6-9-20-15)19-11-13(4)18-16(19)17-10-12(2)3/h6,8-9,11-12,14H,5,7,10H2,1-4H3,(H,17,18).
What are the key properties of 4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine?
4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine has a molecular weight of 291.46 g/mol, XLogP of 4.71, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-methylpropyl)-1-(1-thiophen-2-ylbutyl)imidazol-2-amine is sourced from PubChem (CID 106565325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).