N-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide

C14H21N3O2 — CID 61341444

IUPACN-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide
SMILESCNC(C)c1ccc(NC(=O)N2CCOCC2)cc1
InChIInChI=1S/C14H21N3O2/c1-11(15-2)12-3-5-13(6-4-12)16-14(18)17-7-9-19-10-8-17/h3-6,11,15H,7-10H2,1-2H3,(H,16,18)
InChIKeyLKRFAKSWEZCBHL-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.83
Rot. Bonds3

About N-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide

N-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide (PubChem CID 61341444) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide
PubChem CID61341444
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide
SMILESCNC(C)c1ccc(NC(=O)N2CCOCC2)cc1
InChIInChI=1S/C14H21N3O2/c1-11(15-2)12-3-5-13(6-4-12)16-14(18)17-7-9-19-10-8-17/h3-6,11,15H,7-10H2,1-2H3,(H,16,18)
InChIKeyLKRFAKSWEZCBHL-UHFFFAOYSA-N
XLogP1.83
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[1-(methylamino)ethyl]phenyl]pyrrolidine-1-carboxamide
CID 61339985
N-[4-(methylcarbamoyl)phenyl]morpholine-4-carboxamide
CID 47033018
3-hydroxy-4-methyl-N-[4-[1-(methylamino)ethyl]phenyl]piperidine-1-carboxamide
CID 102964223
N-(4-butan-2-ylphenyl)-4-(morpholine-4-carbonyl)-1,4-diazepane-1-carboxamide
CID 59143459
2-(azocan-1-yl)-2-[4-(morpholine-4-carbonylamino)phenyl]acetic acid
CID 72863317
N-(4-cyanophenyl)morpholine-4-carboxamide
CID 4984315
N-[3-(morpholine-4-carbonylamino)phenyl]morpholine-4-carboxamide
CID 171576986
N-[4-[1-[(1-morpholin-4-yl-1-oxopropan-2-yl)amino]ethyl]phenyl]cyclopropanecarboxamide
CID 47025310
N-(4-propan-2-ylphenyl)-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
CID 3789678
(2R)-2-[furan-2-ylmethyl(methyl)amino]-2-[4-(morpholine-4-carbonylamino)phenyl]acetic acid
CID 97206185
N-(3-acetamidophenyl)morpholine-4-carboxamide
CID 3707113
N-[4-[(4-ethylphenyl)carbamoyl]phenyl]morpholine-4-carboxamide
CID 110178513

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide?
The IUPAC name of N-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide (CID 61341444) is N-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide.
What is the SMILES notation for N-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide?
The canonical SMILES for N-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide is CNC(C)c1ccc(NC(=O)N2CCOCC2)cc1.
What is the InChIKey of N-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide?
The InChIKey is LKRFAKSWEZCBHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-11(15-2)12-3-5-13(6-4-12)16-14(18)17-7-9-19-10-8-17/h3-6,11,15H,7-10H2,1-2H3,(H,16,18).
What are the key properties of N-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide?
N-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.83, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-(methylamino)ethyl]phenyl]morpholine-4-carboxamide is sourced from PubChem (CID 61341444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).