N,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide

C17H22N4O3 — CID 146114825

IUPACN,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide
SMILESCc1ccc(CC(=O)N2CCc3c(cnn3C)C2C(=O)N(C)C)o1
InChIInChI=1S/C17H22N4O3/c1-11-5-6-12(24-11)9-15(22)21-8-7-14-13(10-18-20(14)4)16(21)17(23)19(2)3/h5-6,10,16H,7-9H2,1-4H3
InChIKeyZGLIZQBOEMTWPQ-UHFFFAOYSA-N
MW330.39 g/mol
LogP1.08
Rot. Bonds3

About N,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide

N,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide (PubChem CID 146114825) has the molecular formula C17H22N4O3 and a molecular weight of 330.39 g/mol. Its IUPAC name is N,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide.

Molecular Properties

Compound NameN,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide
PubChem CID146114825
Molecular FormulaC17H22N4O3
Molecular Weight330.39 g/mol
Exact Mass330.17
IUPAC NameN,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide
SMILESCc1ccc(CC(=O)N2CCc3c(cnn3C)C2C(=O)N(C)C)o1
InChIInChI=1S/C17H22N4O3/c1-11-5-6-12(24-11)9-15(22)21-8-7-14-13(10-18-20(14)4)16(21)17(23)19(2)3/h5-6,10,16H,7-9H2,1-4H3
InChIKeyZGLIZQBOEMTWPQ-UHFFFAOYSA-N
XLogP1.08
TPSA71.58 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5-(6-chloro-2-pyridinyl)-N,N,1-trimethyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide
CID 154870395
5-[2-(1-adamantyl)acetyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide
CID 146114810
[(4R)-4-(methoxymethyl)-1-methyl-6,7-dihydro-4H-triazolo[4,5-c]pyridin-5-yl]-(5-methylfuran-2-yl)methanone
CID 97368726
2-methyl-1-[2-(5-methylfuran-2-yl)acetyl]piperidine-2-carboxylic acid
CID 115270705
2,2-dimethyl-1-[2-(5-methylfuran-2-yl)acetyl]piperidin-3-one
CID 115275864
1-(2,2-dimethylpiperazin-1-yl)-2-(5-methylfuran-2-yl)ethanone
CID 115273139
5-[2-(2-methyl-1,3-oxazol-5-yl)acetyl]-6,7-dihydro-4H-furo[3,2-c]pyridine-4-carboxylic acid
CID 167774076
5-[[(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)amino]methyl]furan-2-carboxylic acid
CID 63316834
1-(3-aminopiperidin-1-yl)-2-(5-methylfuran-2-yl)ethanone
CID 115277216
(7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide
CID 135213841
tert-butyl N-[(2S,4S)-2-methyl-1-[2-(5-methylfuran-2-yl)acetyl]piperidin-4-yl]carbamate
CID 97241578
4,4-dimethyl-1-[2-(5-methylfuran-2-yl)acetyl]piperidin-3-one
CID 115276812

Frequently Asked Questions

What is the IUPAC name of N,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide?
The IUPAC name of N,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide (CID 146114825) is N,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide.
What is the SMILES notation for N,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide?
The canonical SMILES for N,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide is Cc1ccc(CC(=O)N2CCc3c(cnn3C)C2C(=O)N(C)C)o1.
What is the InChIKey of N,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide?
The InChIKey is ZGLIZQBOEMTWPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3/c1-11-5-6-12(24-11)9-15(22)21-8-7-14-13(10-18-20(14)4)16(21)17(23)19(2)3/h5-6,10,16H,7-9H2,1-4H3.
What are the key properties of N,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide?
N,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide has a molecular weight of 330.39 g/mol, XLogP of 1.08, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide is sourced from PubChem (CID 146114825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).