3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one

C14H18N2O — CID 3402453

IUPAC3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one
SMILESCc1ccc2c(c1)C(C)(C)C1(C)NC(=O)CN21
InChIInChI=1S/C14H18N2O/c1-9-5-6-11-10(7-9)13(2,3)14(4)15-12(17)8-16(11)14/h5-7H,8H2,1-4H3,(H,15,17)
InChIKeyRRCUVEQOVCHJJL-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.94
Rot. Bonds

About 3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one

3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one (PubChem CID 3402453) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one.

Molecular Properties

Compound Name3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one
PubChem CID3402453
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one
SMILESCc1ccc2c(c1)C(C)(C)C1(C)NC(=O)CN21
InChIInChI=1S/C14H18N2O/c1-9-5-6-11-10(7-9)13(2,3)14(4)15-12(17)8-16(11)14/h5-7H,8H2,1-4H3,(H,15,17)
InChIKeyRRCUVEQOVCHJJL-UHFFFAOYSA-N
XLogP1.94
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one?
The IUPAC name of 3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one (CID 3402453) is 3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one.
What is the SMILES notation for 3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one?
The canonical SMILES for 3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one is Cc1ccc2c(c1)C(C)(C)C1(C)NC(=O)CN21.
What is the InChIKey of 3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one?
The InChIKey is RRCUVEQOVCHJJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-9-5-6-11-10(7-9)13(2,3)14(4)15-12(17)8-16(11)14/h5-7H,8H2,1-4H3,(H,15,17).
What are the key properties of 3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one?
3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one has a molecular weight of 230.31 g/mol, XLogP of 1.94, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3a,4,4,6-tetramethyl-1,3-dihydroimidazo[1,2-a]indol-2-one is sourced from PubChem (CID 3402453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).