(2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide

C16H25N3O2 — CID 119849688

IUPAC(2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide
SMILESCc1cccc(C(CNC(=O)[C@@H](C)N)N2CCOCC2)c1
InChIInChI=1S/C16H25N3O2/c1-12-4-3-5-14(10-12)15(11-18-16(20)13(2)17)19-6-8-21-9-7-19/h3-5,10,13,15H,6-9,11,17H2,1-2H3,(H,18,20)/t13-,15?/m1/s1
InChIKeyCYDVNBQTLPDOLC-AFYYWNPRSA-N
MW291.40 g/mol
LogP0.83
Rot. Bonds5

About (2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide

(2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide (PubChem CID 119849688) has the molecular formula C16H25N3O2 and a molecular weight of 291.40 g/mol. Its IUPAC name is (2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide
PubChem CID119849688
Molecular FormulaC16H25N3O2
Molecular Weight291.40 g/mol
Exact Mass291.19
IUPAC Name(2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide
SMILESCc1cccc(C(CNC(=O)[C@@H](C)N)N2CCOCC2)c1
InChIInChI=1S/C16H25N3O2/c1-12-4-3-5-14(10-12)15(11-18-16(20)13(2)17)19-6-8-21-9-7-19/h3-5,10,13,15H,6-9,11,17H2,1-2H3,(H,18,20)/t13-,15?/m1/s1
InChIKeyCYDVNBQTLPDOLC-AFYYWNPRSA-N
XLogP0.83
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.40
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-2-methyl-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-phenylpropanamide;dihydrochloride
CID 119849677
2-chloro-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]acetamide;hydrochloride
CID 154856473
(2R)-2-amino-N-[2-(4-chlorophenyl)-2-morpholin-4-ylethyl]propanamide
CID 119867147
1-(3-methylbutyl)-3-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]urea
CID 110304148
N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-3-methylsulfonylpropanamide
CID 110623787
N'-(4-aminophenyl)-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]oxamide
CID 166237377
2-(4-fluorophenyl)-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]acetamide
CID 112506492
3-methyl-N-[(2S)-2-(3-methylphenyl)-2-morpholin-4-ylethyl]-1,2-oxazole-5-carboxamide
CID 39226854
(2R)-2-amino-N-[2-(3-chlorophenyl)-2-pyrrolidin-1-ylethyl]propanamide
CID 119849472
2-chloro-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]cyclopentene-1-carboxamide
CID 167784651
N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]-4-pyrrol-1-ylbenzamide
CID 110304128
3-(furan-2-yl)-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide
CID 110304126

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide?
The IUPAC name of (2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide (CID 119849688) is (2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide.
What is the SMILES notation for (2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide?
The canonical SMILES for (2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide is Cc1cccc(C(CNC(=O)[C@@H](C)N)N2CCOCC2)c1.
What is the InChIKey of (2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide?
The InChIKey is CYDVNBQTLPDOLC-AFYYWNPRSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-12-4-3-5-14(10-12)15(11-18-16(20)13(2)17)19-6-8-21-9-7-19/h3-5,10,13,15H,6-9,11,17H2,1-2H3,(H,18,20)/t13-,15?/m1/s1.
What are the key properties of (2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide?
(2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide has a molecular weight of 291.40 g/mol, XLogP of 0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[2-(3-methylphenyl)-2-morpholin-4-ylethyl]propanamide is sourced from PubChem (CID 119849688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).