N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide

C18H19N3O2 — CID 138011361

IUPACN-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide
SMILESN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(=O)n(C2CC2)c1
InChIInChI=1S/C18H19N3O2/c19-17-14-4-2-1-3-11(14)9-15(17)20-18(23)12-5-8-16(22)21(10-12)13-6-7-13/h1-5,8,10,13,15,17H,6-7,9,19H2,(H,20,23)/t15-,17-/m1/s1
InChIKeyJIRIACDGDAQDHF-NVXWUHKLSA-N
MW309.37 g/mol
LogP1.54
Rot. Bonds3

About N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide

N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide (PubChem CID 138011361) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide
PubChem CID138011361
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide
SMILESN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(=O)n(C2CC2)c1
InChIInChI=1S/C18H19N3O2/c19-17-14-4-2-1-3-11(14)9-15(17)20-18(23)12-5-8-16(22)21(10-12)13-6-7-13/h1-5,8,10,13,15,17H,6-7,9,19H2,(H,20,23)/t15-,17-/m1/s1
InChIKeyJIRIACDGDAQDHF-NVXWUHKLSA-N
XLogP1.54
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide with MolForge

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Related Compounds

N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]pyridine-4-carboxamide
CID 142582886
N-[(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-phenylpyrazole-4-carboxamide
CID 74244794
N-[(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-phenylimidazo[1,2-a]pyridine-6-carboxamide;dihydrochloride
CID 154896783
N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopentylpyrazole-3-carboxamide
CID 138011380
N-[(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-yl]propanamide
CID 165456832
N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-3-ethyl-1-methylpyrazole-4-carboxamide
CID 138027230
N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-4-(hydroxymethyl)piperidine-1-carboxamide
CID 138016659
N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine
CID 144626033
N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide
CID 166991162
N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide
CID 138011377
N-[(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-methyl-3-propylpyrazole-5-carboxamide
CID 70784279
N-[(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-yl]-3-propan-2-yl-1,2-oxazole-5-carboxamide
CID 74244390

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide?
The IUPAC name of N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide (CID 138011361) is N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide is N[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(=O)n(C2CC2)c1.
What is the InChIKey of N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide?
The InChIKey is JIRIACDGDAQDHF-NVXWUHKLSA-N. The full InChI is InChI=1S/C18H19N3O2/c19-17-14-4-2-1-3-11(14)9-15(17)20-18(23)12-5-8-16(22)21(10-12)13-6-7-13/h1-5,8,10,13,15,17H,6-7,9,19H2,(H,20,23)/t15-,17-/m1/s1.
What are the key properties of N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide?
N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 1.54, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-1-cyclopropyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 138011361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).