(7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide

C11H17N5O3 — CID 135213841

IUPAC(7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide
SMILESCN(C)C(=O)[C@H]1c2c(cnn2C)CCN1C(=O)NO
InChIInChI=1S/C11H17N5O3/c1-14(2)10(17)9-8-7(6-12-15(8)3)4-5-16(9)11(18)13-19/h6,9,19H,4-5H2,1-3H3,(H,13,18)/t9-/m1/s1
InChIKeyASTHBBRTJUHLBW-SECBINFHSA-N
MW267.29 g/mol
LogP-0.49
Rot. Bonds1

About (7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide

(7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide (PubChem CID 135213841) has the molecular formula C11H17N5O3 and a molecular weight of 267.29 g/mol. Its IUPAC name is (7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide.

Molecular Properties

Compound Name(7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide
PubChem CID135213841
Molecular FormulaC11H17N5O3
Molecular Weight267.29 g/mol
Exact Mass267.13
IUPAC Name(7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide
SMILESCN(C)C(=O)[C@H]1c2c(cnn2C)CCN1C(=O)NO
InChIInChI=1S/C11H17N5O3/c1-14(2)10(17)9-8-7(6-12-15(8)3)4-5-16(9)11(18)13-19/h6,9,19H,4-5H2,1-3H3,(H,13,18)/t9-/m1/s1
InChIKeyASTHBBRTJUHLBW-SECBINFHSA-N
XLogP-0.49
TPSA90.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-[(7S)-7-(ethoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-3-(2-methylphenyl)propan-1-one
CID 97467885
1,6-dimethyl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxylic acid
CID 175361043
[(7R)-7-(cyclopropylmethoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-phenylmethanone
CID 97467932
1-[(7R)-7-(methoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-2-thiophen-2-ylethanone
CID 97467856
(E)-1-[7-(ethoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-3-thiophen-2-ylprop-2-en-1-one
CID 131645775
1-[7-(ethoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-3-(2-methylphenyl)propan-1-one;2,2,2-trifluoroacetic acid
CID 155828168
5-(6-chloro-2-pyridinyl)-N,N,1-trimethyl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide
CID 154870395
N,N,1-trimethyl-5-[2-(5-methylfuran-2-yl)acetyl]-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-4-carboxamide
CID 146114825
1-[(7R)-7-(cyclopropylmethoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-2-(4-methylphenyl)ethanone
CID 97467937
[(7S)-7-(cyclopropylmethoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-(5-methyl-1,2-oxazol-4-yl)methanone
CID 124811735
N-cyclopropyl-1-methyl-4,5,6,7-tetrahydroindazol-7-amine
CID 83907429
[7-(cyclopropylmethoxymethyl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl]-pyridin-3-ylmethanone;2,2,2-trifluoroacetic acid
CID 171692392

Frequently Asked Questions

What is the IUPAC name of (7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide?
The IUPAC name of (7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide (CID 135213841) is (7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide.
What is the SMILES notation for (7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide?
The canonical SMILES for (7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide is CN(C)C(=O)[C@H]1c2c(cnn2C)CCN1C(=O)NO.
What is the InChIKey of (7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide?
The InChIKey is ASTHBBRTJUHLBW-SECBINFHSA-N. The full InChI is InChI=1S/C11H17N5O3/c1-14(2)10(17)9-8-7(6-12-15(8)3)4-5-16(9)11(18)13-19/h6,9,19H,4-5H2,1-3H3,(H,13,18)/t9-/m1/s1.
What are the key properties of (7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide?
(7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide has a molecular weight of 267.29 g/mol, XLogP of -0.49, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-6-N-hydroxy-7-N,7-N,1-trimethyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6,7-dicarboxamide is sourced from PubChem (CID 135213841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).