N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide

C17H19N3O — CID 138049844

IUPACN-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide
SMILESCc1ccncc1CC(=O)N[C@@H]1Cc2ccccc2[C@H]1N
InChIInChI=1S/C17H19N3O/c1-11-6-7-19-10-13(11)9-16(21)20-15-8-12-4-2-3-5-14(12)17(15)18/h2-7,10,15,17H,8-9,18H2,1H3,(H,20,21)/t15-,17-/m1/s1
InChIKeyBDKFVWTXOUQAAM-NVXWUHKLSA-N
MW281.36 g/mol
LogP1.67
Rot. Bonds3

About N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide

N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide (PubChem CID 138049844) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide.

Molecular Properties

Compound NameN-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide
PubChem CID138049844
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC NameN-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide
SMILESCc1ccncc1CC(=O)N[C@@H]1Cc2ccccc2[C@H]1N
InChIInChI=1S/C17H19N3O/c1-11-6-7-19-10-13(11)9-16(21)20-15-8-12-4-2-3-5-14(12)17(15)18/h2-7,10,15,17H,8-9,18H2,1H3,(H,20,21)/t15-,17-/m1/s1
InChIKeyBDKFVWTXOUQAAM-NVXWUHKLSA-N
XLogP1.67
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-[4-(trifluoromethyl)-3-pyridinyl]acetamide
CID 138011362
N-[(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-yl]propanamide
CID 165456832
N-[(1R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-methoxyacetamide
CID 166991162
N-[(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-yl]-3-(1-methylpyrazol-4-yl)propanamide;hydrochloride
CID 154901298
N-(2-aminocyclopropyl)-2-(2-methylphenyl)acetamide
CID 43593844
N-[(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(5-fluoro-2-methyl-1H-indol-3-yl)acetamide
CID 74251445
N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(benzotriazol-1-yl)acetamide;dihydrochloride
CID 154577752
3-ethyl-N-[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-yl]pyridine-4-carboxamide
CID 99842360
N-(1-amino-2,3-dihydro-1H-inden-2-yl)hydroxylamine
CID 144626033
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]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide
CID 138011377
N-(2-hydroxy-2,3-dihydro-1H-inden-1-yl)-2-pyridin-3-ylacetamide
CID 62690720

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide?
The IUPAC name of N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide (CID 138049844) is N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide.
What is the SMILES notation for N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide?
The canonical SMILES for N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide is Cc1ccncc1CC(=O)N[C@@H]1Cc2ccccc2[C@H]1N.
What is the InChIKey of N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide?
The InChIKey is BDKFVWTXOUQAAM-NVXWUHKLSA-N. The full InChI is InChI=1S/C17H19N3O/c1-11-6-7-19-10-13(11)9-16(21)20-15-8-12-4-2-3-5-14(12)17(15)18/h2-7,10,15,17H,8-9,18H2,1H3,(H,20,21)/t15-,17-/m1/s1.
What are the key properties of N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide?
N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide has a molecular weight of 281.36 g/mol, XLogP of 1.67, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-(4-methyl-3-pyridinyl)acetamide is sourced from PubChem (CID 138049844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).