5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine

C14H20N4 — CID 107587276

IUPAC5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine
SMILESCc1cncc(Nc2nc(C)cn2CC(C)C)c1
InChIInChI=1S/C14H20N4/c1-10(2)8-18-9-12(4)16-14(18)17-13-5-11(3)6-15-7-13/h5-7,9-10H,8H2,1-4H3,(H,16,17)
InChIKeyWKBVVOGCNRNAMS-UHFFFAOYSA-N
MW244.34 g/mol
LogP3.29
Rot. Bonds4

About 5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine

5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine (PubChem CID 107587276) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine.

Molecular Properties

Compound Name5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine
PubChem CID107587276
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine
SMILESCc1cncc(Nc2nc(C)cn2CC(C)C)c1
InChIInChI=1S/C14H20N4/c1-10(2)8-18-9-12(4)16-14(18)17-13-5-11(3)6-15-7-13/h5-7,9-10H,8H2,1-4H3,(H,16,17)
InChIKeyWKBVVOGCNRNAMS-UHFFFAOYSA-N
XLogP3.29
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine?
The IUPAC name of 5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine (CID 107587276) is 5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine.
What is the SMILES notation for 5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine?
The canonical SMILES for 5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine is Cc1cncc(Nc2nc(C)cn2CC(C)C)c1.
What is the InChIKey of 5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine?
The InChIKey is WKBVVOGCNRNAMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-10(2)8-18-9-12(4)16-14(18)17-13-5-11(3)6-15-7-13/h5-7,9-10H,8H2,1-4H3,(H,16,17).
What are the key properties of 5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine?
5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine has a molecular weight of 244.34 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[4-methyl-1-(2-methylpropyl)imidazol-2-yl]pyridin-3-amine is sourced from PubChem (CID 107587276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).