N-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide

C30H32N4O4 — CID 171684341

IUPACN-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCOc1cc(C(=O)N2CCC(c3ccc(NC(=O)c4cnn5cccc(C)c45)cc3)CC2)cc(OC)c1C
InChIInChI=1S/C30H32N4O4/c1-19-6-5-13-34-28(19)25(18-31-34)29(35)32-24-9-7-21(8-10-24)22-11-14-33(15-12-22)30(36)23-16-26(37-3)20(2)27(17-23)38-4/h5-10,13,16-18,22H,11-12,14-15H2,1-4H3,(H,32,35)
InChIKeyWTHIXGLEJNMRMI-UHFFFAOYSA-N
MW512.61 g/mol
LogP5.24
Rot. Bonds6

About N-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide

N-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 171684341) has the molecular formula C30H32N4O4 and a molecular weight of 512.61 g/mol. Its IUPAC name is N-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID171684341
Molecular FormulaC30H32N4O4
Molecular Weight512.61 g/mol
Exact Mass512.24
IUPAC NameN-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCOc1cc(C(=O)N2CCC(c3ccc(NC(=O)c4cnn5cccc(C)c45)cc3)CC2)cc(OC)c1C
InChIInChI=1S/C30H32N4O4/c1-19-6-5-13-34-28(19)25(18-31-34)29(35)32-24-9-7-21(8-10-24)22-11-14-33(15-12-22)30(36)23-16-26(37-3)20(2)27(17-23)38-4/h5-10,13,16-18,22H,11-12,14-15H2,1-4H3,(H,32,35)
InChIKeyWTHIXGLEJNMRMI-UHFFFAOYSA-N
XLogP5.24
TPSA85.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500512.61
LogP ≤ 55.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-chloro-N-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-1H-pyrrolo[2,3-b]pyridine-5-carboxamide
CID 171685466
N-[4-[1-(6-fluoroimidazo[1,2-a]pyridine-2-carbonyl)piperidin-4-yl]phenyl]-3,5-dimethoxy-4-methylbenzamide
CID 171681380
methyl 6-[4-[4-([1,2,4]triazolo[1,5-a]pyridine-2-carbonylamino)phenyl]piperidine-1-carbonyl]naphthalene-2-carboxylate
CID 171681800
N-[4-[1-(4-methoxy-3,5-dimethylbenzoyl)piperidin-4-yl]phenyl]-1-pyridin-3-ylpyrazole-4-carboxamide
CID 171683368
2,4-difluoro-3,5-dimethoxy-N-[4-[1-(quinoxaline-2-carbonyl)piperidin-4-yl]phenyl]benzamide
CID 171698533
(2S)-N-[4-[1-(4-fluoropyrazolo[1,5-a]pyridine-3-carbonyl)piperidin-4-yl]phenyl]-2-methoxy-2-naphthalen-1-ylpropanamide
CID 171684618
N-[4-[1-(5-methyl-1H-pyrrole-3-carbonyl)piperidin-4-yl]phenyl]-1-phenyl-5-(trifluoromethyl)pyrazole-4-carboxamide
CID 171681203
2,6-dimethoxy-N-[4-[1-[4-[(2-methylpropan-2-yl)oxy]benzoyl]piperidin-4-yl]phenyl]benzamide
CID 171685751
N-[4-[1-(3,4-dimethoxybenzoyl)piperidin-4-yl]phenyl]-7-fluoro-2H-indazole-3-carboxamide
CID 171685415
N-[4-[1-(4,5-dimethoxy-2-methylbenzoyl)piperidin-4-yl]phenyl]-2-(4-fluorophenoxy)acetamide
CID 171685696
N-(3,4-dimethoxyphenyl)-4-[3-(pyrrolidine-1-carbonyl)pyrazolo[1,5-a]pyridin-5-yl]piperidine-1-carboxamide
CID 50848915
N-[4-[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]phenyl]-3-fluoro-2-nitrobenzamide
CID 171684890

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide (CID 171684341) is N-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide is COc1cc(C(=O)N2CCC(c3ccc(NC(=O)c4cnn5cccc(C)c45)cc3)CC2)cc(OC)c1C.
What is the InChIKey of N-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is WTHIXGLEJNMRMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H32N4O4/c1-19-6-5-13-34-28(19)25(18-31-34)29(35)32-24-9-7-21(8-10-24)22-11-14-33(15-12-22)30(36)23-16-26(37-3)20(2)27(17-23)38-4/h5-10,13,16-18,22H,11-12,14-15H2,1-4H3,(H,32,35).
What are the key properties of N-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide?
N-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 512.61 g/mol, XLogP of 5.24, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-(3,5-dimethoxy-4-methylbenzoyl)piperidin-4-yl]phenyl]-4-methylpyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 171684341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).