[(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone

C20H23N3O2 — CID 124955708

IUPAC[(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone
SMILESCc1cc(N)cc([C@H]2CN(C(=O)c3ccc4c(c3)CCC4)CCO2)n1
InChIInChI=1S/C20H23N3O2/c1-13-9-17(21)11-18(22-13)19-12-23(7-8-25-19)20(24)16-6-5-14-3-2-4-15(14)10-16/h5-6,9-11,19H,2-4,7-8,12H2,1H3,(H2,21,22)/t19-/m1/s1
InChIKeyFLWDPDHWNJNTBD-LJQANCHMSA-N
MW337.42 g/mol
LogP2.67
Rot. Bonds2

About [(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone

[(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone (PubChem CID 124955708) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is [(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone.

Molecular Properties

Compound Name[(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone
PubChem CID124955708
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC Name[(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone
SMILESCc1cc(N)cc([C@H]2CN(C(=O)c3ccc4c(c3)CCC4)CCO2)n1
InChIInChI=1S/C20H23N3O2/c1-13-9-17(21)11-18(22-13)19-12-23(7-8-25-19)20(24)16-6-5-14-3-2-4-15(14)10-16/h5-6,9-11,19H,2-4,7-8,12H2,1H3,(H2,21,22)/t19-/m1/s1
InChIKeyFLWDPDHWNJNTBD-LJQANCHMSA-N
XLogP2.67
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone?
The IUPAC name of [(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone (CID 124955708) is [(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone.
What is the SMILES notation for [(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone?
The canonical SMILES for [(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone is Cc1cc(N)cc([C@H]2CN(C(=O)c3ccc4c(c3)CCC4)CCO2)n1.
What is the InChIKey of [(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone?
The InChIKey is FLWDPDHWNJNTBD-LJQANCHMSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-13-9-17(21)11-18(22-13)19-12-23(7-8-25-19)20(24)16-6-5-14-3-2-4-15(14)10-16/h5-6,9-11,19H,2-4,7-8,12H2,1H3,(H2,21,22)/t19-/m1/s1.
What are the key properties of [(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone?
[(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone has a molecular weight of 337.42 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2-(4-amino-6-methyl-2-pyridinyl)morpholin-4-yl]-(2,3-dihydro-1H-inden-5-yl)methanone is sourced from PubChem (CID 124955708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).