(2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide

C16H21N5O — CID 95740693

IUPAC(2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide
SMILESCc1ncc2c(n1)CCC[C@@H]2NC(=O)[C@@H](C)n1nccc1C
InChIInChI=1S/C16H21N5O/c1-10-7-8-18-21(10)11(2)16(22)20-15-6-4-5-14-13(15)9-17-12(3)19-14/h7-9,11,15H,4-6H2,1-3H3,(H,20,22)/t11-,15+/m1/s1
InChIKeyQFZVQAFHUAMAEO-ABAIWWIYSA-N
MW299.38 g/mol
LogP2.04
Rot. Bonds3

About (2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide

(2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide (PubChem CID 95740693) has the molecular formula C16H21N5O and a molecular weight of 299.38 g/mol. Its IUPAC name is (2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide.

Molecular Properties

Compound Name(2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide
PubChem CID95740693
Molecular FormulaC16H21N5O
Molecular Weight299.38 g/mol
Exact Mass299.17
IUPAC Name(2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide
SMILESCc1ncc2c(n1)CCC[C@@H]2NC(=O)[C@@H](C)n1nccc1C
InChIInChI=1S/C16H21N5O/c1-10-7-8-18-21(10)11(2)16(22)20-15-6-4-5-14-13(15)9-17-12(3)19-14/h7-9,11,15H,4-6H2,1-3H3,(H,20,22)/t11-,15+/m1/s1
InChIKeyQFZVQAFHUAMAEO-ABAIWWIYSA-N
XLogP2.04
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide 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

2-(5-methylpyrazol-1-yl)-N-(1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl)propanamide
CID 56731383
(2S)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]-2-[3-(trifluoromethyl)pyrazol-1-yl]propanamide
CID 95740686
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
2-methyl-N-[(5R)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]furan-3-carboxamide
CID 95740744
2-(4-fluorophenyl)-N-(2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl)acetamide
CID 71689758
N,2-dimethyl-5,6,7,8-tetrahydroquinazolin-5-amine
CID 62008486
2-methyl-N-(2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl)quinoline-3-carboxamide
CID 71689676
3-cyclopropyl-1-methyl-N-(2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl)pyrazole-5-carboxamide
CID 71689682
4-methyl-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]thiadiazole-5-carboxamide
CID 95740697
2-(1-hydroxycyclohexyl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide
CID 95930428
N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]-4-(tetrazol-1-yl)benzamide
CID 95740937

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide?
The IUPAC name of (2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide (CID 95740693) is (2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide.
What is the SMILES notation for (2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide?
The canonical SMILES for (2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide is Cc1ncc2c(n1)CCC[C@@H]2NC(=O)[C@@H](C)n1nccc1C.
What is the InChIKey of (2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide?
The InChIKey is QFZVQAFHUAMAEO-ABAIWWIYSA-N. The full InChI is InChI=1S/C16H21N5O/c1-10-7-8-18-21(10)11(2)16(22)20-15-6-4-5-14-13(15)9-17-12(3)19-14/h7-9,11,15H,4-6H2,1-3H3,(H,20,22)/t11-,15+/m1/s1.
What are the key properties of (2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide?
(2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide has a molecular weight of 299.38 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(5-methylpyrazol-1-yl)-N-[(5S)-2-methyl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide is sourced from PubChem (CID 95740693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).