N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide

C19H31N3O3 — CID 95311551

IUPACN-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide
SMILESCOc1ccc([C@@H](NC(=O)CNC[C@@H]2CN(C)CCO2)C(C)C)cc1
InChIInChI=1S/C19H31N3O3/c1-14(2)19(15-5-7-16(24-4)8-6-15)21-18(23)12-20-11-17-13-22(3)9-10-25-17/h5-8,14,17,19-20H,9-13H2,1-4H3,(H,21,23)/t17-,19+/m1/s1
InChIKeyWZYPWLCEOKXSOQ-MJGOQNOKSA-N
MW349.48 g/mol
LogP1.43
Rot. Bonds8

About N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide

N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide (PubChem CID 95311551) has the molecular formula C19H31N3O3 and a molecular weight of 349.48 g/mol. Its IUPAC name is N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide.

Molecular Properties

Compound NameN-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide
PubChem CID95311551
Molecular FormulaC19H31N3O3
Molecular Weight349.48 g/mol
Exact Mass349.24
IUPAC NameN-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide
SMILESCOc1ccc([C@@H](NC(=O)CNC[C@@H]2CN(C)CCO2)C(C)C)cc1
InChIInChI=1S/C19H31N3O3/c1-14(2)19(15-5-7-16(24-4)8-6-15)21-18(23)12-20-11-17-13-22(3)9-10-25-17/h5-8,14,17,19-20H,9-13H2,1-4H3,(H,21,23)/t17-,19+/m1/s1
InChIKeyWZYPWLCEOKXSOQ-MJGOQNOKSA-N
XLogP1.43
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.48
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide with MolForge

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Related Compounds

N-[cyclopropyl-(4-methoxyphenyl)methyl]-2-[(4-methylmorpholin-2-yl)methylamino]acetamide
CID 56802966
2-(cyclopropylmethylamino)-N-[1-(4-methoxyphenyl)-2-methylpropyl]acetamide;hydrochloride
CID 119693481
N-(3-methylbutan-2-yl)-2-[(4-methylmorpholin-2-yl)methylamino]acetamide
CID 78945317
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide
CID 95336812
2-[(4-methylmorpholin-2-yl)methylamino]-N-pentan-3-ylacetamide
CID 78945150
2-(2,5-dimethylmorpholin-4-yl)-N-[1-(4-methoxyphenyl)-2-methylpropyl]acetamide
CID 134007317
N-(4-bromophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]acetamide
CID 78960546
2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]acetamide
CID 92763021
2-(4-hydroxypiperidin-1-yl)-N-[(1R)-1-(4-methoxyphenyl)-2-methylpropyl]acetamide
CID 41335963
N-(2,6-dichlorophenyl)-2-[(4-methylmorpholin-2-yl)methylamino]acetamide
CID 78960893
2-(4-methoxyphenoxy)-N-[(1R)-1-(4-methoxyphenyl)-2-methylpropyl]acetamide
CID 9048684
2-[(4-methylmorpholin-2-yl)methylamino]-N-propylacetamide
CID 78945295

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide?
The IUPAC name of N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide (CID 95311551) is N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide.
What is the SMILES notation for N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide?
The canonical SMILES for N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide is COc1ccc([C@@H](NC(=O)CNC[C@@H]2CN(C)CCO2)C(C)C)cc1.
What is the InChIKey of N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide?
The InChIKey is WZYPWLCEOKXSOQ-MJGOQNOKSA-N. The full InChI is InChI=1S/C19H31N3O3/c1-14(2)19(15-5-7-16(24-4)8-6-15)21-18(23)12-20-11-17-13-22(3)9-10-25-17/h5-8,14,17,19-20H,9-13H2,1-4H3,(H,21,23)/t17-,19+/m1/s1.
What are the key properties of N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide?
N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide has a molecular weight of 349.48 g/mol, XLogP of 1.43, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]acetamide is sourced from PubChem (CID 95311551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).