N-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide

C14H25N3O3 — CID 141179166

IUPACN-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide
SMILESCC(=O)N[C@H]1[C@H](CN2C[C@@H](C)O[C@@H](C)C2)OC=C[C@@H]1N
InChIInChI=1S/C14H25N3O3/c1-9-6-17(7-10(2)20-9)8-13-14(16-11(3)18)12(15)4-5-19-13/h4-5,9-10,12-14H,6-8,15H2,1-3H3,(H,16,18)/t9-,10+,12-,13-,14+/m0/s1
InChIKeyOYZLRRNLMIQXJQ-ONCHEJIZSA-N
MW283.37 g/mol
LogP-0.16
Rot. Bonds3

About N-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide

N-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide (PubChem CID 141179166) has the molecular formula C14H25N3O3 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide.

Molecular Properties

Compound NameN-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide
PubChem CID141179166
Molecular FormulaC14H25N3O3
Molecular Weight283.37 g/mol
Exact Mass283.19
IUPAC NameN-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide
SMILESCC(=O)N[C@H]1[C@H](CN2C[C@@H](C)O[C@@H](C)C2)OC=C[C@@H]1N
InChIInChI=1S/C14H25N3O3/c1-9-6-17(7-10(2)20-9)8-13-14(16-11(3)18)12(15)4-5-19-13/h4-5,9-10,12-14H,6-8,15H2,1-3H3,(H,16,18)/t9-,10+,12-,13-,14+/m0/s1
InChIKeyOYZLRRNLMIQXJQ-ONCHEJIZSA-N
XLogP-0.16
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide with MolForge

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Related Compounds

N-[(2S,3R,4S)-4-azido-2-(diethylaminomethyl)-3,4-dihydro-2H-pyran-3-yl]acetamide
CID 141179172
N-[(2S,3R,4S)-4-amino-2-(diethylaminomethyl)-3,4-dihydro-2H-pyran-3-yl]acetamide
CID 141179173
2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]-N-prop-2-enylacetamide
CID 60543143
2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-dimethylpropanamide
CID 62064201
2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N-ethylpropanamide
CID 62064202
2-[4-(3,4-dihydro-2H-pyran-2-ylmethylamino)piperidin-1-yl]acetamide
CID 62064229
1-[4-(3,4-dihydro-2H-pyran-2-ylmethylamino)piperidin-1-yl]-2-methoxyethanone
CID 62064231
1-[4-(3,4-dihydro-2H-pyran-2-ylmethylamino)piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 62064232
1-[4-(3,4-dihydro-2H-pyran-2-ylmethylamino)piperidin-1-yl]-2-methylpropan-1-one
CID 62064233
2-(3,4-dihydro-2H-pyran-2-ylmethylamino)-N,N-diethylpropanamide
CID 62064401
ethyl 4-(3,4-dihydro-2H-pyran-2-ylmethylamino)piperidine-1-carboxylate
CID 62064539
2-[4-(3,4-dihydro-2H-pyran-2-ylmethylamino)piperidin-1-yl]-N-methylacetamide
CID 62064559

Frequently Asked Questions

What is the IUPAC name of N-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide?
The IUPAC name of N-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide (CID 141179166) is N-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide.
What is the SMILES notation for N-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide?
The canonical SMILES for N-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide is CC(=O)N[C@H]1[C@H](CN2C[C@@H](C)O[C@@H](C)C2)OC=C[C@@H]1N.
What is the InChIKey of N-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide?
The InChIKey is OYZLRRNLMIQXJQ-ONCHEJIZSA-N. The full InChI is InChI=1S/C14H25N3O3/c1-9-6-17(7-10(2)20-9)8-13-14(16-11(3)18)12(15)4-5-19-13/h4-5,9-10,12-14H,6-8,15H2,1-3H3,(H,16,18)/t9-,10+,12-,13-,14+/m0/s1.
What are the key properties of N-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide?
N-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide has a molecular weight of 283.37 g/mol, XLogP of -0.16, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S,3R,4S)-4-amino-2-[[(2R,6S)-2,6-dimethylmorpholin-4-yl]methyl]-3,4-dihydro-2H-pyran-3-yl]acetamide is sourced from PubChem (CID 141179166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).