(3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide

C19H24N2O4 — CID 97071356

IUPAC(3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide
SMILESCO[C@H](CNC(=O)N1CCOC[C@@H]1c1ccc(C)o1)c1ccccc1
InChIInChI=1S/C19H24N2O4/c1-14-8-9-17(25-14)16-13-24-11-10-21(16)19(22)20-12-18(23-2)15-6-4-3-5-7-15/h3-9,16,18H,10-13H2,1-2H3,(H,20,22)/t16-,18-/m1/s1
InChIKeyAFAXASLDAOCZQN-SJLPKXTDSA-N
MW344.41 g/mol
LogP3.06
Rot. Bonds5

About (3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide

(3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide (PubChem CID 97071356) has the molecular formula C19H24N2O4 and a molecular weight of 344.41 g/mol. Its IUPAC name is (3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide.

Molecular Properties

Compound Name(3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide
PubChem CID97071356
Molecular FormulaC19H24N2O4
Molecular Weight344.41 g/mol
Exact Mass344.17
IUPAC Name(3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide
SMILESCO[C@H](CNC(=O)N1CCOC[C@@H]1c1ccc(C)o1)c1ccccc1
InChIInChI=1S/C19H24N2O4/c1-14-8-9-17(25-14)16-13-24-11-10-21(16)19(22)20-12-18(23-2)15-6-4-3-5-7-15/h3-9,16,18H,10-13H2,1-2H3,(H,20,22)/t16-,18-/m1/s1
InChIKeyAFAXASLDAOCZQN-SJLPKXTDSA-N
XLogP3.06
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide?
The IUPAC name of (3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide (CID 97071356) is (3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide.
What is the SMILES notation for (3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide?
The canonical SMILES for (3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide is CO[C@H](CNC(=O)N1CCOC[C@@H]1c1ccc(C)o1)c1ccccc1.
What is the InChIKey of (3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide?
The InChIKey is AFAXASLDAOCZQN-SJLPKXTDSA-N. The full InChI is InChI=1S/C19H24N2O4/c1-14-8-9-17(25-14)16-13-24-11-10-21(16)19(22)20-12-18(23-2)15-6-4-3-5-7-15/h3-9,16,18H,10-13H2,1-2H3,(H,20,22)/t16-,18-/m1/s1.
What are the key properties of (3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide?
(3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide has a molecular weight of 344.41 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-[(2S)-2-methoxy-2-phenylethyl]-3-(5-methylfuran-2-yl)morpholine-4-carboxamide is sourced from PubChem (CID 97071356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).