1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine

C14H23N5O — CID 106568458

IUPAC1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine
SMILESCOCC(C)n1cc(C)nc1NCCc1nccn1C
InChIInChI=1S/C14H23N5O/c1-11-9-19(12(2)10-20-4)14(17-11)16-6-5-13-15-7-8-18(13)3/h7-9,12H,5-6,10H2,1-4H3,(H,16,17)
InChIKeyLNTBUKLKIYGHQF-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.79
Rot. Bonds7

About 1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine

1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine (PubChem CID 106568458) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is 1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine.

Molecular Properties

Compound Name1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine
PubChem CID106568458
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine
SMILESCOCC(C)n1cc(C)nc1NCCc1nccn1C
InChIInChI=1S/C14H23N5O/c1-11-9-19(12(2)10-20-4)14(17-11)16-6-5-13-15-7-8-18(13)3/h7-9,12H,5-6,10H2,1-4H3,(H,16,17)
InChIKeyLNTBUKLKIYGHQF-UHFFFAOYSA-N
XLogP1.79
TPSA56.90 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]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-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine
CID 106554728
1-butan-2-yl-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106554900
1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(2,2,2-trifluoroethoxy)ethyl]imidazol-2-amine
CID 106573349
1-(1-methoxypropan-2-yl)-4-methyl-N-(3-methylbutan-2-yl)imidazol-2-amine
CID 106554321
1-(1-methoxypropan-2-yl)-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]imidazol-2-amine
CID 106571790
N-(1-methoxy-3-methylbutan-2-yl)-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106575059
1-(1-methoxypropan-2-yl)-4-methyl-N-(2-methylpyrazol-3-yl)imidazol-2-amine
CID 106565839
1-(1-methoxypropan-2-yl)-4-methyl-N-(pyridin-3-ylmethyl)imidazol-2-amine
CID 106560455
1-(1-methoxypropan-2-yl)-4-methyl-N-(4-methylpentan-2-yl)imidazol-2-amine
CID 106561678
1-hexan-2-yl-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106569745
3-[2-(1-methylimidazol-2-yl)ethylamino]-1-propan-2-ylpyrazin-2-one
CID 62939874
N-[[1-(dimethylamino)cyclobutyl]methyl]-1-(1-methoxypropan-2-yl)-4-methylimidazol-2-amine
CID 106583085

Frequently Asked Questions

What is the IUPAC name of 1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine?
The IUPAC name of 1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine (CID 106568458) is 1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine.
What is the SMILES notation for 1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine?
The canonical SMILES for 1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine is COCC(C)n1cc(C)nc1NCCc1nccn1C.
What is the InChIKey of 1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine?
The InChIKey is LNTBUKLKIYGHQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-11-9-19(12(2)10-20-4)14(17-11)16-6-5-13-15-7-8-18(13)3/h7-9,12H,5-6,10H2,1-4H3,(H,16,17).
What are the key properties of 1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine?
1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine has a molecular weight of 277.37 g/mol, XLogP of 1.79, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methoxypropan-2-yl)-4-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]imidazol-2-amine is sourced from PubChem (CID 106568458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).