N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine

C12H20N6O — CID 106569960

IUPACN-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine
SMILESCOCC(C)Nc1nc(C)cn1Cc1nncn1C
InChIInChI=1S/C12H20N6O/c1-9-5-18(6-11-16-13-8-17(11)3)12(14-9)15-10(2)7-19-4/h5,8,10H,6-7H2,1-4H3,(H,14,15)
InChIKeyQCXFFHMEKVSDKG-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.82
Rot. Bonds6

About N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine

N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine (PubChem CID 106569960) has the molecular formula C12H20N6O and a molecular weight of 264.33 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine
PubChem CID106569960
Molecular FormulaC12H20N6O
Molecular Weight264.33 g/mol
Exact Mass264.17
IUPAC NameN-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine
SMILESCOCC(C)Nc1nc(C)cn1Cc1nncn1C
InChIInChI=1S/C12H20N6O/c1-9-5-18(6-11-16-13-8-17(11)3)12(14-9)15-10(2)7-19-4/h5,8,10H,6-7H2,1-4H3,(H,14,15)
InChIKeyQCXFFHMEKVSDKG-UHFFFAOYSA-N
XLogP0.82
TPSA69.79 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

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-[(4,5-dimethylthiophen-2-yl)methyl]-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106573869
1-[(2-ethylphenyl)methyl]-N-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106574539
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
N-(1-methoxypropan-2-yl)-4-methyl-1-(2-methylsulfinylpropyl)imidazol-2-amine
CID 106581065
N-(1-methoxypropan-2-yl)-4-methyl-1-(2-methyl-2-methylsulfanylpropyl)imidazol-2-amine
CID 106580909
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-(2-thiophen-3-ylethyl)imidazol-2-amine
CID 106567535
1-(2-methoxyethyl)-4-methyl-N-(1-methylsulfanylpropan-2-yl)imidazol-2-amine
CID 106581332
3-N-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]-1-N,1-N-dimethylbutane-1,3-diamine
CID 106567740

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine?
The IUPAC name of N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine (CID 106569960) is N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine?
The canonical SMILES for N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine is COCC(C)Nc1nc(C)cn1Cc1nncn1C.
What is the InChIKey of N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine?
The InChIKey is QCXFFHMEKVSDKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N6O/c1-9-5-18(6-11-16-13-8-17(11)3)12(14-9)15-10(2)7-19-4/h5,8,10H,6-7H2,1-4H3,(H,14,15).
What are the key properties of N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine?
N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine has a molecular weight of 264.33 g/mol, XLogP of 0.82, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-4-methyl-1-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-2-amine is sourced from PubChem (CID 106569960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).