N-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide

C15H23N3O2 — CID 61424962

IUPACN-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide
SMILESCCC1COC(C)CN1C(=O)Nc1ccc(CN)cc1
InChIInChI=1S/C15H23N3O2/c1-3-14-10-20-11(2)9-18(14)15(19)17-13-6-4-12(8-16)5-7-13/h4-7,11,14H,3,8-10,16H2,1-2H3,(H,17,19)
InChIKeySFWYYWCYZREDPY-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.18
Rot. Bonds3

About N-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide

N-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide (PubChem CID 61424962) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide
PubChem CID61424962
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide
SMILESCCC1COC(C)CN1C(=O)Nc1ccc(CN)cc1
InChIInChI=1S/C15H23N3O2/c1-3-14-10-20-11(2)9-18(14)15(19)17-13-6-4-12(8-16)5-7-13/h4-7,11,14H,3,8-10,16H2,1-2H3,(H,17,19)
InChIKeySFWYYWCYZREDPY-UHFFFAOYSA-N
XLogP2.18
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(aminomethyl)phenyl]-1-(5-ethyl-2-methylmorpholin-4-yl)ethanone
CID 63589592
N-[4-(aminomethyl)phenyl]-2-(5-ethyl-2-methylmorpholin-4-yl)acetamide
CID 43575816
[5-(aminomethyl)-2-pyridinyl]-(5-ethyl-2-methylmorpholin-4-yl)methanone
CID 55229054
N-[4-(aminomethyl)phenyl]-2-ethylazepane-1-carboxamide
CID 104690862
[4-[(5-ethyl-2-methylmorpholin-4-yl)methyl]phenyl]methanamine
CID 43575811
N-[3-(aminomethyl)phenyl]-2-(5-ethyl-2-methylmorpholin-4-yl)acetamide
CID 43575815
N-[4-(aminomethyl)phenyl]-2-(2,5-dimethylmorpholin-4-yl)propanamide
CID 43544268
N-[4-(aminomethyl)phenyl]-3,4-dihydroxypyrrolidine-1-carboxamide
CID 106670528
2-[4-(aminomethyl)phenyl]-1-(2,5-dimethylmorpholin-4-yl)ethanone
CID 55213909
N-(4-aminophenyl)-2-(5-ethyl-2-methylmorpholin-4-yl)acetamide
CID 43575099
cyclopropyl-(5-ethyl-2-methylmorpholin-4-yl)methanone
CID 60645279
[(2R,5S)-5-ethyl-2-methylmorpholin-4-yl]-phenylmethanone
CID 95358527

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide?
The IUPAC name of N-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide (CID 61424962) is N-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide is CCC1COC(C)CN1C(=O)Nc1ccc(CN)cc1.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide?
The InChIKey is SFWYYWCYZREDPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-3-14-10-20-11(2)9-18(14)15(19)17-13-6-4-12(8-16)5-7-13/h4-7,11,14H,3,8-10,16H2,1-2H3,(H,17,19).
What are the key properties of N-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide?
N-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 2.18, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-5-ethyl-2-methylmorpholine-4-carboxamide is sourced from PubChem (CID 61424962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).