2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide

C19H20N4O — CID 95740709

IUPAC2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide
SMILESCc1ncc2c(n1)CCC[C@H]2NC(=O)Cn1ccc2ccccc21
InChIInChI=1S/C19H20N4O/c1-13-20-11-15-16(21-13)6-4-7-17(15)22-19(24)12-23-10-9-14-5-2-3-8-18(14)23/h2-3,5,8-11,17H,4,6-7,12H2,1H3,(H,22,24)/t17-/m1/s1
InChIKeyRQNKSFKFESPYET-QGZVFWFLSA-N
MW320.40 g/mol
LogP2.93
Rot. Bonds3

About 2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide

2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide (PubChem CID 95740709) has the molecular formula C19H20N4O and a molecular weight of 320.40 g/mol. Its IUPAC name is 2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide.

Molecular Properties

Compound Name2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide
PubChem CID95740709
Molecular FormulaC19H20N4O
Molecular Weight320.40 g/mol
Exact Mass320.16
IUPAC Name2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide
SMILESCc1ncc2c(n1)CCC[C@H]2NC(=O)Cn1ccc2ccccc21
InChIInChI=1S/C19H20N4O/c1-13-20-11-15-16(21-13)6-4-7-17(15)22-19(24)12-23-10-9-14-5-2-3-8-18(14)23/h2-3,5,8-11,17H,4,6-7,12H2,1H3,(H,22,24)/t17-/m1/s1
InChIKeyRQNKSFKFESPYET-QGZVFWFLSA-N
XLogP2.93
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.40
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-fluorophenyl)-N-(2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl)acetamide
CID 71689758
3-(4-methylindazol-1-yl)-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide
CID 95740732
2-(2-cyanophenoxy)-N-(2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl)acetamide
CID 71689664
2-(1-hydroxycyclohexyl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide
CID 95930428
N-[(1R)-5,6-dimethoxy-2,3-dihydro-1H-inden-1-yl]-2-indol-1-ylacetamide
CID 125432031
2-methyl-N-(2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl)quinoline-3-carboxamide
CID 71689676
N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]thiophene-2-carboxamide
CID 95740668
N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]furan-2-carboxamide
CID 95740666
N-[(5S)-2-(dimethylamino)-5,6,7,8-tetrahydroquinazolin-5-yl]-2-piperidin-1-ylacetamide
CID 25303679
N-(2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl)-3-(phenoxymethyl)furan-2-carboxamide
CID 139001804
4-methyl-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]thiadiazole-5-carboxamide
CID 95740697
2-methyl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]furan-3-carboxamide
CID 95740744

Frequently Asked Questions

What is the IUPAC name of 2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide?
The IUPAC name of 2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide (CID 95740709) is 2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide.
What is the SMILES notation for 2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide?
The canonical SMILES for 2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide is Cc1ncc2c(n1)CCC[C@H]2NC(=O)Cn1ccc2ccccc21.
What is the InChIKey of 2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide?
The InChIKey is RQNKSFKFESPYET-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H20N4O/c1-13-20-11-15-16(21-13)6-4-7-17(15)22-19(24)12-23-10-9-14-5-2-3-8-18(14)23/h2-3,5,8-11,17H,4,6-7,12H2,1H3,(H,22,24)/t17-/m1/s1.
What are the key properties of 2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide?
2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide has a molecular weight of 320.40 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-indol-1-yl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide is sourced from PubChem (CID 95740709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).