6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide

C24H29N5O2 — CID 166705833

About 6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide

6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide (PubChem CID 166705833) has the molecular formula C24H29N5O2 and a molecular weight of 419.53 g/mol. Its IUPAC name is 6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide.

Molecular Properties

• Compound Name: 6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide
• PubChem CID: 166705833
• Molecular Formula: C24H29N5O2
• Molecular Weight: 419.53 g/mol
• Exact Mass: 419.23
• IUPAC Name: 6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide
• SMILES: CCC1(CC)CC(=O)N(Cc2cccc(C(=O)N[C@H]3CCc4ccccc43)n2)C(N)=N1
• InChI: InChI=1S/C24H29N5O2/c1-3-24(4-2)14-21(30)29(23(25)28-24)15-17-9-7-11-20(26-17)22(31)27-19-13-12-16-8-5-6-10-18(16)19/h5-11,19H,3-4,12-15H2,1-2H3,(H2,25,28)(H,27,31)/t19-/m0/s1
• InChIKey: GWPNTDZXFIEWDB-IBGZPJMESA-N
• XLogP: 3.10
• TPSA: 100.68 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 5
• Rotatable Bonds: 6
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	419.53
LogP ≤ 5	3.10
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide?

The IUPAC name of 6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide (CID 166705833) is 6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide.

What is the SMILES notation for 6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide?

The canonical SMILES for 6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide is CCC1(CC)CC(=O)N(Cc2cccc(C(=O)N[C@H]3CCc4ccccc43)n2)C(N)=N1.

What is the InChIKey of 6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide?

The InChIKey is GWPNTDZXFIEWDB-IBGZPJMESA-N. The full InChI is InChI=1S/C24H29N5O2/c1-3-24(4-2)14-21(30)29(23(25)28-24)15-17-9-7-11-20(26-17)22(31)27-19-13-12-16-8-5-6-10-18(16)19/h5-11,19H,3-4,12-15H2,1-2H3,(H2,25,28)(H,27,31)/t19-/m0/s1.

What are the key properties of 6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide?

6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide has a molecular weight of 419.53 g/mol, XLogP of 3.10, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 6-[(2-amino-4,4-diethyl-6-oxo-5H-pyrimidin-1-yl)methyl]-N-[(1S)-2,3-dihydro-1H-inden-1-yl]pyridine-2-carboxamide is sourced from PubChem (CID 166705833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).