(10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one

C15H20N2O — CID 659196

IUPAC(10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one
SMILESCc1ccc2c(c1)C(C)(C)[C@]1(C)NC(=O)CCN21
InChIInChI=1S/C15H20N2O/c1-10-5-6-12-11(9-10)14(2,3)15(4)16-13(18)7-8-17(12)15/h5-6,9H,7-8H2,1-4H3,(H,16,18)/t15-/m1/s1
InChIKeyJELKXMQISFGPPJ-OAHLLOKOSA-N
MW244.34 g/mol
LogP2.33
Rot. Bonds

About (10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one

(10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one (PubChem CID 659196) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is (10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one.

Molecular Properties

Compound Name(10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one
PubChem CID659196
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name(10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one
SMILESCc1ccc2c(c1)C(C)(C)[C@]1(C)NC(=O)CCN21
InChIInChI=1S/C15H20N2O/c1-10-5-6-12-11(9-10)14(2,3)15(4)16-13(18)7-8-17(12)15/h5-6,9H,7-8H2,1-4H3,(H,16,18)/t15-/m1/s1
InChIKeyJELKXMQISFGPPJ-OAHLLOKOSA-N
XLogP2.33
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one?
The IUPAC name of (10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one (CID 659196) is (10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one.
What is the SMILES notation for (10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one?
The canonical SMILES for (10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one is Cc1ccc2c(c1)C(C)(C)[C@]1(C)NC(=O)CCN21.
What is the InChIKey of (10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one?
The InChIKey is JELKXMQISFGPPJ-OAHLLOKOSA-N. The full InChI is InChI=1S/C15H20N2O/c1-10-5-6-12-11(9-10)14(2,3)15(4)16-13(18)7-8-17(12)15/h5-6,9H,7-8H2,1-4H3,(H,16,18)/t15-/m1/s1.
What are the key properties of (10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one?
(10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one has a molecular weight of 244.34 g/mol, XLogP of 2.33, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (10aR)-8,10,10,10a-tetramethyl-3,4-dihydro-1H-pyrimido[1,2-a]indol-2-one is sourced from PubChem (CID 659196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).