N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride

C16H25ClN2O2 — CID 119717401

IUPACN-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride
SMILESCc1ccc(C(C)N(C)C(=O)CC2CNCCO2)cc1.Cl
InChIInChI=1S/C16H24N2O2.ClH/c1-12-4-6-14(7-5-12)13(2)18(3)16(19)10-15-11-17-8-9-20-15;/h4-7,13,15,17H,8-11H2,1-3H3;1H
InChIKeyBIRSDOPRYBATDV-UHFFFAOYSA-N
MW312.84 g/mol
LogP2.31
Rot. Bonds4

About N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride

N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride (PubChem CID 119717401) has the molecular formula C16H25ClN2O2 and a molecular weight of 312.84 g/mol. Its IUPAC name is N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride
PubChem CID119717401
Molecular FormulaC16H25ClN2O2
Molecular Weight312.84 g/mol
Exact Mass312.16
IUPAC NameN-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride
SMILESCc1ccc(C(C)N(C)C(=O)CC2CNCCO2)cc1.Cl
InChIInChI=1S/C16H24N2O2.ClH/c1-12-4-6-14(7-5-12)13(2)18(3)16(19)10-15-11-17-8-9-20-15;/h4-7,13,15,17H,8-11H2,1-3H3;1H
InChIKeyBIRSDOPRYBATDV-UHFFFAOYSA-N
XLogP2.31
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.84
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-morpholin-2-yl-N-propan-2-ylacetamide
CID 66434341
N-[1-(2,4-dichlorophenyl)ethyl]-N-methyl-2-morpholin-2-ylacetamide;hydrochloride
CID 119717480
N-methyl-N-[1-(4-methylphenyl)ethyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119717403
N-methyl-N-[(2-methylphenyl)methyl]-2-morpholin-2-ylacetamide
CID 66433193
N-methyl-N-[(3-methylphenyl)methyl]-2-morpholin-2-ylacetamide
CID 66429127
2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride
CID 119686106
N-methyl-N-[1-(4-methylphenyl)ethyl]-2-piperazin-1-ylacetamide
CID 60939432
N-(5-bromo-2-methylphenyl)-N-methyl-2-morpholin-2-ylacetamide
CID 115178201
N-[(2-chlorophenyl)methyl]-N-methyl-2-morpholin-2-ylacetamide
CID 66429544
N-cyclopentyl-N-methyl-2-morpholin-2-ylacetamide;hydrochloride
CID 119696960
N,N-diethyl-2-morpholin-2-ylacetamide
CID 66435692
(3S)-N-methyl-N-[1-(4-methylphenyl)ethyl]piperidine-3-carboxamide
CID 81129873

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride?
The IUPAC name of N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride (CID 119717401) is N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride.
What is the SMILES notation for N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride?
The canonical SMILES for N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride is Cc1ccc(C(C)N(C)C(=O)CC2CNCCO2)cc1.Cl.
What is the InChIKey of N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride?
The InChIKey is BIRSDOPRYBATDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2.ClH/c1-12-4-6-14(7-5-12)13(2)18(3)16(19)10-15-11-17-8-9-20-15;/h4-7,13,15,17H,8-11H2,1-3H3;1H.
What are the key properties of N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride?
N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride has a molecular weight of 312.84 g/mol, XLogP of 2.31, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(4-methylphenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride is sourced from PubChem (CID 119717401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).