N-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride

C14H20Cl2N2O2 — CID 119716523

IUPACN-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride
SMILESCCC(NC(=O)C1CNCCO1)c1cccc(Cl)c1.Cl
InChIInChI=1S/C14H19ClN2O2.ClH/c1-2-12(10-4-3-5-11(15)8-10)17-14(18)13-9-16-6-7-19-13;/h3-5,8,12-13,16H,2,6-7,9H2,1H3,(H,17,18);1H
InChIKeyYEYKQACIWAGNAX-UHFFFAOYSA-N
MW319.23 g/mol
LogP2.32
Rot. Bonds4

About N-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride

N-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride (PubChem CID 119716523) has the molecular formula C14H20Cl2N2O2 and a molecular weight of 319.23 g/mol. Its IUPAC name is N-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride
PubChem CID119716523
Molecular FormulaC14H20Cl2N2O2
Molecular Weight319.23 g/mol
Exact Mass318.09
IUPAC NameN-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride
SMILESCCC(NC(=O)C1CNCCO1)c1cccc(Cl)c1.Cl
InChIInChI=1S/C14H19ClN2O2.ClH/c1-2-12(10-4-3-5-11(15)8-10)17-14(18)13-9-16-6-7-19-13;/h3-5,8,12-13,16H,2,6-7,9H2,1H3,(H,17,18);1H
InChIKeyYEYKQACIWAGNAX-UHFFFAOYSA-N
XLogP2.32
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.23
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(4-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride
CID 119699910
N-[1-(3-chlorophenyl)ethyl]morpholine-2-carboxamide;hydrochloride
CID 119685359
N-[(1R)-1-(3-chlorophenyl)ethyl]morpholine-2-carboxamide
CID 81372205
N-[1-(2,4-difluorophenyl)propyl]morpholine-2-carboxamide;hydrochloride
CID 119796312
N-[2-(3-chlorophenoxy)propyl]morpholine-2-carboxamide;hydrochloride
CID 119807139
N-[1-(2-ethoxyphenyl)propyl]morpholine-2-carboxamide
CID 119721402
N-[1-(3-chlorophenyl)propyl]-6-oxopiperidine-3-carboxamide
CID 112728875
N-[1-(3-chlorophenyl)propyl]-4-methoxypyrrolidine-2-carboxamide
CID 61214763
N-[1-[3-(trifluoromethyl)phenyl]ethyl]morpholine-2-carboxamide;hydrochloride
CID 119686341
N-[(2S)-1-hydroxybutan-2-yl]morpholine-2-carboxamide
CID 107222342
N-[2-(4-methylphenyl)-1-pyridin-3-ylethyl]morpholine-2-carboxamide;dihydrochloride
CID 91645725
N-[2-(3-methylphenoxy)butyl]morpholine-2-carboxamide
CID 119819907

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride (CID 119716523) is N-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride is CCC(NC(=O)C1CNCCO1)c1cccc(Cl)c1.Cl.
What is the InChIKey of N-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride?
The InChIKey is YEYKQACIWAGNAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O2.ClH/c1-2-12(10-4-3-5-11(15)8-10)17-14(18)13-9-16-6-7-19-13;/h3-5,8,12-13,16H,2,6-7,9H2,1H3,(H,17,18);1H.
What are the key properties of N-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride?
N-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride has a molecular weight of 319.23 g/mol, XLogP of 2.32, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-chlorophenyl)propyl]morpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119716523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).