(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine

C22H29N3O2 — CID 124738760

IUPAC(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine
SMILESc1ccc([C@H](NC[C@@H]([C@H]2CCOC2)N2CCOCC2)c2ccccn2)cc1
InChIInChI=1S/C22H29N3O2/c1-2-6-18(7-3-1)22(20-8-4-5-10-23-20)24-16-21(19-9-13-27-17-19)25-11-14-26-15-12-25/h1-8,10,19,21-22,24H,9,11-17H2/t19-,21-,22-/m0/s1
InChIKeyRQAHSMVLVHZAIK-BVSLBCMMSA-N
MW367.49 g/mol
LogP2.50
Rot. Bonds7

About (2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine

(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine (PubChem CID 124738760) has the molecular formula C22H29N3O2 and a molecular weight of 367.49 g/mol. Its IUPAC name is (2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine.

Molecular Properties

Compound Name(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine
PubChem CID124738760
Molecular FormulaC22H29N3O2
Molecular Weight367.49 g/mol
Exact Mass367.23
IUPAC Name(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine
SMILESc1ccc([C@H](NC[C@@H]([C@H]2CCOC2)N2CCOCC2)c2ccccn2)cc1
InChIInChI=1S/C22H29N3O2/c1-2-6-18(7-3-1)22(20-8-4-5-10-23-20)24-16-21(19-9-13-27-17-19)25-11-14-26-15-12-25/h1-8,10,19,21-22,24H,9,11-17H2/t19-,21-,22-/m0/s1
InChIKeyRQAHSMVLVHZAIK-BVSLBCMMSA-N
XLogP2.50
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.49
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine with MolForge

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Related Compounds

2-morpholin-4-yl-2-(oxolan-3-yl)-N-[phenyl(pyridin-2-yl)methyl]ethanamine
CID 75449073
(2S)-N-[(S)-(4-bromophenyl)-(furan-2-yl)methyl]-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]ethanamine
CID 124855740
(2S)-N-[(2S)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]-2-phenylbutanamide
CID 94150246
N-(dicyclopropylmethyl)-2-morpholin-4-yl-2-(oxolan-3-yl)ethanamine
CID 75382652
1-[cyclopropyl(phenyl)methyl]-3-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]urea
CID 55590697
N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-1-phenyltetrazol-5-amine
CID 42943739
N-[oxolan-3-yl(pyridin-2-yl)methyl]ethanamine
CID 63565313
2-methyl-1-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-3-(2-phenyl-2-pyrrolidin-1-ylethyl)guanidine;hydroiodide
CID 111326635
(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]-N-[(1S)-1-(1-propan-2-ylpyrazol-4-yl)ethyl]ethanamine
CID 97085962
2-methoxy-N-[(2R)-2-morpholin-4-yl-2-[(3S)-oxolan-3-yl]ethyl]pyridine-3-carboxamide
CID 94024269
1-(2-chlorophenyl)-3-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]urea
CID 55696727
N-[2-morpholin-4-yl-2-(oxolan-3-yl)ethyl]-2-(2-oxopiperidin-1-yl)-2-phenylacetamide
CID 56514384

Frequently Asked Questions

What is the IUPAC name of (2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine?
The IUPAC name of (2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine (CID 124738760) is (2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine.
What is the SMILES notation for (2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine?
The canonical SMILES for (2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine is c1ccc([C@H](NC[C@@H]([C@H]2CCOC2)N2CCOCC2)c2ccccn2)cc1.
What is the InChIKey of (2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine?
The InChIKey is RQAHSMVLVHZAIK-BVSLBCMMSA-N. The full InChI is InChI=1S/C22H29N3O2/c1-2-6-18(7-3-1)22(20-8-4-5-10-23-20)24-16-21(19-9-13-27-17-19)25-11-14-26-15-12-25/h1-8,10,19,21-22,24H,9,11-17H2/t19-,21-,22-/m0/s1.
What are the key properties of (2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine?
(2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine has a molecular weight of 367.49 g/mol, XLogP of 2.50, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-morpholin-4-yl-2-[(3R)-oxolan-3-yl]-N-[(S)-phenyl(pyridin-2-yl)methyl]ethanamine is sourced from PubChem (CID 124738760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).