4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide

C21H30N4O3 — CID 24791112

IUPAC4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide
SMILESCOc1ccc(C(=O)NCc2cnn(C)c2)cc1OC1CCN(C(C)C)CC1
InChIInChI=1S/C21H30N4O3/c1-15(2)25-9-7-18(8-10-25)28-20-11-17(5-6-19(20)27-4)21(26)22-12-16-13-23-24(3)14-16/h5-6,11,13-15,18H,7-10,12H2,1-4H3,(H,22,26)
InChIKeyNEXYZRZQLHVMLV-UHFFFAOYSA-N
MW386.50 g/mol
LogP2.61
Rot. Bonds7

About 4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide

4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide (PubChem CID 24791112) has the molecular formula C21H30N4O3 and a molecular weight of 386.50 g/mol. Its IUPAC name is 4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide.

Molecular Properties

Compound Name4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide
PubChem CID24791112
Molecular FormulaC21H30N4O3
Molecular Weight386.50 g/mol
Exact Mass386.23
IUPAC Name4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide
SMILESCOc1ccc(C(=O)NCc2cnn(C)c2)cc1OC1CCN(C(C)C)CC1
InChIInChI=1S/C21H30N4O3/c1-15(2)25-9-7-18(8-10-25)28-20-11-17(5-6-19(20)27-4)21(26)22-12-16-13-23-24(3)14-16/h5-6,11,13-15,18H,7-10,12H2,1-4H3,(H,22,26)
InChIKeyNEXYZRZQLHVMLV-UHFFFAOYSA-N
XLogP2.61
TPSA68.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.50
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide 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

3-Cyclopentyloxy-N-(3,5-dimethyl-pyridin-4-yl)-4-methoxy-benzamide
CID 9974519
3-cyclopentyloxy-4-methoxy-N-pyridin-4-yl-benzamide
CID 10041213
3-Cyclopentyloxy-4-methoxy-N-(2,3,5-trifluoro-pyridin-4-yl)-benzamide
CID 10406571
N-(2-(3,5-dimethyl-1H-pyrazol-1-yl)-2-oxoethyl)-2,3-dihydrobenzo[b][1,4]dioxine-6-carboxamide
CID 658961
N-benzyl-1-(2-cyanoethyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1H-pyrazole-4-carboxamide
CID 2474145
3,4,5-triethoxy-N'-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methylene]benzohydrazide
CID 5431522
4-({1-[(dimethylamino)sulfonyl]-4-piperidinyl}oxy)-N-ethyl-N-[(1-methyl-1H-pyrazol-4-yl)methyl]benzamide
CID 16187695
4-{[1-(2-phenylethyl)piperidin-4-yl]oxy}-N-[2-(1H-pyrazol-1-yl)ethyl]benzamide
CID 16191083
1-[(3-methyl-1-propyl-1H-pyrazol-4-yl)methyl]-4-[4-(1-pyrrolidinylcarbonyl)phenoxy]piperidine
CID 24791615
N-[(1,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-[(1-isopropyl-4-piperidinyl)oxy]-4-methoxybenzamide
CID 24793427
N-cyclopropyl-3-[1-[(1-ethyl-5-methylpyrazol-4-yl)methyl]piperidin-4-yl]oxy-4-methoxybenzamide
CID 24817311
[4-[[1-[(1-Isopropylpyrazol-4-yl)methyl]-4-piperidyl]oxy]phenyl]-pyrrolidino-methanone
CID 24819295

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide?
The IUPAC name of 4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide (CID 24791112) is 4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide.
What is the SMILES notation for 4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide?
The canonical SMILES for 4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide is COc1ccc(C(=O)NCc2cnn(C)c2)cc1OC1CCN(C(C)C)CC1.
What is the InChIKey of 4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide?
The InChIKey is NEXYZRZQLHVMLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H30N4O3/c1-15(2)25-9-7-18(8-10-25)28-20-11-17(5-6-19(20)27-4)21(26)22-12-16-13-23-24(3)14-16/h5-6,11,13-15,18H,7-10,12H2,1-4H3,(H,22,26).
What are the key properties of 4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide?
4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide has a molecular weight of 386.50 g/mol, XLogP of 2.61, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(1-methylpyrazol-4-yl)methyl]-3-(1-propan-2-ylpiperidin-4-yl)oxybenzamide is sourced from PubChem (CID 24791112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).