N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide

C17H19N3O2 — CID 138011377

IUPACN-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide
SMILESCc1nc(C2CC2)oc1C(=O)N[C@@H]1Cc2ccccc2[C@H]1N
InChIInChI=1S/C17H19N3O2/c1-9-15(22-17(19-9)10-6-7-10)16(21)20-13-8-11-4-2-3-5-12(11)14(13)18/h2-5,10,13-14H,6-8,18H2,1H3,(H,20,21)/t13-,14-/m1/s1
InChIKeyIMAXUVFQBUGFPQ-ZIAGYGMSSA-N
MW297.36 g/mol
LogP2.21
Rot. Bonds3

About N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide

N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide (PubChem CID 138011377) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide
PubChem CID138011377
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC NameN-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide
SMILESCc1nc(C2CC2)oc1C(=O)N[C@@H]1Cc2ccccc2[C@H]1N
InChIInChI=1S/C17H19N3O2/c1-9-15(22-17(19-9)10-6-7-10)16(21)20-13-8-11-4-2-3-5-12(11)14(13)18/h2-5,10,13-14H,6-8,18H2,1H3,(H,20,21)/t13-,14-/m1/s1
InChIKeyIMAXUVFQBUGFPQ-ZIAGYGMSSA-N
XLogP2.21
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-amino-2,3-dihydro-1H-inden-2-yl)-4-methyl-2-propan-2-yl-1,3-thiazole-5-carboxamide
CID 156604265
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]propanamide
CID 165456832
N-[(1R,2R)-1-[(2-chloroacetyl)amino]-2,3-dihydro-1H-inden-2-yl]-2-(cyclopropylmethyl)-4-methyl-1,3-oxazole-5-carboxamide
CID 154875791
N-[(1S,2S)-1-amino-2,3-dihydro-1H-inden-2-yl]-3-propan-2-yl-1,2-oxazole-5-carboxamide
CID 74244390
N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopentylpyrazole-3-carboxamide
CID 138011380
ethyl 2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-4-methyl-1,3-oxazole-5-carboxylate
CID 66395605
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]-3-ethyl-1-methylpyrazole-4-carboxamide
CID 138027230
methyl 2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxylate
CID 130703206
3-[(2-cyclopropyl-4-methyl-1,3-oxazole-5-carbonyl)amino]butanoic acid
CID 120522817
2,4-dimethyl-N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]-1,3-oxazole-5-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide?
The IUPAC name of N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide (CID 138011377) is N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide is Cc1nc(C2CC2)oc1C(=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-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide?
The InChIKey is IMAXUVFQBUGFPQ-ZIAGYGMSSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-9-15(22-17(19-9)10-6-7-10)16(21)20-13-8-11-4-2-3-5-12(11)14(13)18/h2-5,10,13-14H,6-8,18H2,1H3,(H,20,21)/t13-,14-/m1/s1.
What are the key properties of N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide?
N-[(1R,2R)-1-amino-2,3-dihydro-1H-inden-2-yl]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide has a molecular weight of 297.36 g/mol, XLogP of 2.21, 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]-2-cyclopropyl-4-methyl-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 138011377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).