(1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide

C11H13NO2 — CID 129027598

IUPAC(1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide
SMILESC[C@@]1(C(=O)NO)CCc2ccccc21
InChIInChI=1S/C11H13NO2/c1-11(10(13)12-14)7-6-8-4-2-3-5-9(8)11/h2-5,14H,6-7H2,1H3,(H,12,13)/t11-/m1/s1
InChIKeyXSTSKTLGIURXCC-LLVKDONJSA-N
MW191.23 g/mol
LogP1.40
Rot. Bonds1

About (1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide

(1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide (PubChem CID 129027598) has the molecular formula C11H13NO2 and a molecular weight of 191.23 g/mol. Its IUPAC name is (1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide.

Molecular Properties

Compound Name(1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide
PubChem CID129027598
Molecular FormulaC11H13NO2
Molecular Weight191.23 g/mol
Exact Mass191.09
IUPAC Name(1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide
SMILESC[C@@]1(C(=O)NO)CCc2ccccc21
InChIInChI=1S/C11H13NO2/c1-11(10(13)12-14)7-6-8-4-2-3-5-9(8)11/h2-5,14H,6-7H2,1H3,(H,12,13)/t11-/m1/s1
InChIKeyXSTSKTLGIURXCC-LLVKDONJSA-N
XLogP1.40
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

(1S)-1-methyl-2,3-dihydroindene-1-carboxylic acid
CID 124509477
1-methyl-N-[3-(methylamino)propyl]-3,4-dihydro-2H-naphthalene-1-carboxamide
CID 119429829
1-methyl-N-pyrrolidin-3-yl-3,4-dihydro-2H-naphthalene-1-carboxamide
CID 119449830
2-[2-[(1-methyl-3,4-dihydro-2H-naphthalene-1-carbonyl)amino]ethylsulfanyl]acetic acid
CID 119242345
methyl N-(1-methyl-2,3-dihydroinden-1-yl)carbamate
CID 145156027
(1R)-1-methyl-N-pyridin-3-ylsulfonyl-3,4-dihydro-2H-naphthalene-1-carboxamide
CID 96523094
3,3-dimethyl-N-[(1S)-1-methyl-2,3-dihydroinden-1-yl]butanamide
CID 122550804
N-[2-(2-hydroxyethyl)pentyl]-1-methyl-3,4-dihydro-2H-naphthalene-1-carboxamide
CID 111662301
1-methyl-N-(3-methylpiperidin-4-yl)-3,4-dihydro-2H-naphthalene-1-carboxamide
CID 120557540
5-methyl-6,7,8,9-tetrahydrobenzo[7]annulen-5-ol
CID 15751789
1-anilino-2,3-dihydroindene-1-carboxylic acid
CID 12740130
methyl 1-hydroxy-2,3-dihydroindene-1-carboxylate
CID 62213056

Frequently Asked Questions

What is the IUPAC name of (1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide?
The IUPAC name of (1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide (CID 129027598) is (1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide.
What is the SMILES notation for (1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide?
The canonical SMILES for (1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide is C[C@@]1(C(=O)NO)CCc2ccccc21.
What is the InChIKey of (1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide?
The InChIKey is XSTSKTLGIURXCC-LLVKDONJSA-N. The full InChI is InChI=1S/C11H13NO2/c1-11(10(13)12-14)7-6-8-4-2-3-5-9(8)11/h2-5,14H,6-7H2,1H3,(H,12,13)/t11-/m1/s1.
What are the key properties of (1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide?
(1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide has a molecular weight of 191.23 g/mol, XLogP of 1.40, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-hydroxy-1-methyl-2,3-dihydroindene-1-carboxamide is sourced from PubChem (CID 129027598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).