4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine

C13H18N4 — CID 106560368

IUPAC4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine
SMILESCc1cn(C(C)C)c(NCc2ccncc2)n1
InChIInChI=1S/C13H18N4/c1-10(2)17-9-11(3)16-13(17)15-8-12-4-6-14-7-5-12/h4-7,9-10H,8H2,1-3H3,(H,15,16)
InChIKeyNMUQOSZBEKJTMZ-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.78
Rot. Bonds4

About 4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine

4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine (PubChem CID 106560368) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine.

Molecular Properties

Compound Name4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine
PubChem CID106560368
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine
SMILESCc1cn(C(C)C)c(NCc2ccncc2)n1
InChIInChI=1S/C13H18N4/c1-10(2)17-9-11(3)16-13(17)15-8-12-4-6-14-7-5-12/h4-7,9-10H,8H2,1-3H3,(H,15,16)
InChIKeyNMUQOSZBEKJTMZ-UHFFFAOYSA-N
XLogP2.78
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)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-ethyl-4-methyl-N-(pyridin-4-ylmethyl)imidazol-2-amine
CID 106560389
4-methyl-N-(naphthalen-1-ylmethyl)-1-propan-2-ylimidazol-2-amine
CID 106571375
1-(1-methoxypropan-2-yl)-4-methyl-N-(pyridin-3-ylmethyl)imidazol-2-amine
CID 106560455
4-methyl-N-(2-methylsulfanylethyl)-1-propan-2-ylimidazol-2-amine
CID 106572589
N-(3-methoxypropyl)-4-methyl-1-(1-pyridin-4-ylethyl)imidazol-2-amine
CID 106562044
1-butan-2-yl-N-ethyl-4-methylimidazol-2-amine
CID 106554895
1-ethyl-4-methyl-N-[(4-propan-2-ylphenyl)methyl]imidazol-2-amine
CID 106567350
4-methyl-1-propan-2-yl-N-(4-propylphenyl)imidazol-2-amine
CID 106561547
N-(4-methyl-1-propan-2-ylimidazol-2-yl)pyridin-3-amine
CID 106555167
N-(3-ethoxypropyl)-4-methyl-1-(1-pyridin-4-ylethyl)imidazol-2-amine
CID 106562010
4-methyl-1-propan-2-yl-N-(1-thiophen-2-ylpropan-2-yl)imidazol-2-amine
CID 106573480
3-methyl-N-(pyridin-4-ylmethyl)pyrazin-2-amine
CID 83063577

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine?
The IUPAC name of 4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine (CID 106560368) is 4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine.
What is the SMILES notation for 4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine?
The canonical SMILES for 4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine is Cc1cn(C(C)C)c(NCc2ccncc2)n1.
What is the InChIKey of 4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine?
The InChIKey is NMUQOSZBEKJTMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-10(2)17-9-11(3)16-13(17)15-8-12-4-6-14-7-5-12/h4-7,9-10H,8H2,1-3H3,(H,15,16).
What are the key properties of 4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine?
4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine has a molecular weight of 230.31 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-propan-2-yl-N-(pyridin-4-ylmethyl)imidazol-2-amine is sourced from PubChem (CID 106560368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).