N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide

C24H24N4O3 — CID 70742181

IUPACN-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)Nc2nn(Cc3ccccc3)c3cc(OC(C)C)ccc23)c[nH]1
InChIInChI=1S/C24H24N4O3/c1-15(2)31-18-9-10-19-21(12-18)28(14-17-7-5-4-6-8-17)27-23(19)26-24(30)20-13-25-16(3)11-22(20)29/h4-13,15H,14H2,1-3H3,(H,25,29)(H,26,27,30)
InChIKeyDUXNLATWMPZJOJ-UHFFFAOYSA-N
MW416.48 g/mol
LogP4.12
Rot. Bonds6

About N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide

N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide (PubChem CID 70742181) has the molecular formula C24H24N4O3 and a molecular weight of 416.48 g/mol. Its IUPAC name is N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
PubChem CID70742181
Molecular FormulaC24H24N4O3
Molecular Weight416.48 g/mol
Exact Mass416.18
IUPAC NameN-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCc1cc(=O)c(C(=O)Nc2nn(Cc3ccccc3)c3cc(OC(C)C)ccc23)c[nH]1
InChIInChI=1S/C24H24N4O3/c1-15(2)31-18-9-10-19-21(12-18)28(14-17-7-5-4-6-8-17)27-23(19)26-24(30)20-13-25-16(3)11-22(20)29/h4-13,15H,14H2,1-3H3,(H,25,29)(H,26,27,30)
InChIKeyDUXNLATWMPZJOJ-UHFFFAOYSA-N
XLogP4.12
TPSA89.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.48
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)pyrazine-2-carboxamide
CID 70734149
N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-2-methylpyrazole-3-carboxamide
CID 70760119
6-methyl-4-oxo-N-phenyl-1H-pyridine-3-carboxamide
CID 110856546
6-methyl-4-oxo-N-[4-(1-phenylethylamino)phenyl]-1H-pyridine-3-carboxamide
CID 131962645
3-ethyl-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]-1,2-oxazole-5-carboxamide
CID 70761670
N-[1-[[4-(difluoromethoxy)phenyl]methyl]indazol-3-yl]-3-methoxybenzamide
CID 24954488
6-methyl-4-oxo-N-(2-phenoxybutyl)-1H-pyridine-3-carboxamide
CID 75375675
(1-benzyl-6-methoxyindazol-3-yl)-phenylmethanone
CID 10472547
N-[1-[[4-(difluoromethoxy)phenyl]methyl]indazol-3-yl]pyridine-4-carboxamide
CID 24954489
6-methyl-4-oxo-N-(2-propan-2-yloxyethyl)-1H-pyridine-3-carboxamide
CID 104578609
N-[3-(ethylaminomethyl)phenyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide;hydrochloride
CID 119438297
(2R)-2-(4-methylpyrazol-1-yl)-N-[6-propan-2-yloxy-1-(2,2,2-trifluoroethyl)indazol-3-yl]propanamide
CID 95867189

Frequently Asked Questions

What is the IUPAC name of N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide (CID 70742181) is N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide is Cc1cc(=O)c(C(=O)Nc2nn(Cc3ccccc3)c3cc(OC(C)C)ccc23)c[nH]1.
What is the InChIKey of N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The InChIKey is DUXNLATWMPZJOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O3/c1-15(2)31-18-9-10-19-21(12-18)28(14-17-7-5-4-6-8-17)27-23(19)26-24(30)20-13-25-16(3)11-22(20)29/h4-13,15H,14H2,1-3H3,(H,25,29)(H,26,27,30).
What are the key properties of N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide has a molecular weight of 416.48 g/mol, XLogP of 4.12, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzyl-6-propan-2-yloxyindazol-3-yl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 70742181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).