N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide

C9H19N3O2 — CID 82506232

IUPACN-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide
SMILESCCC1CN(C(=O)NCCN)CCO1
InChIInChI=1S/C9H19N3O2/c1-2-8-7-12(5-6-14-8)9(13)11-4-3-10/h8H,2-7,10H2,1H3,(H,11,13)
InChIKeyKPLLZQVVJFQSHD-UHFFFAOYSA-N
MW201.27 g/mol
LogP-0.23
Rot. Bonds3

About N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide

N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide (PubChem CID 82506232) has the molecular formula C9H19N3O2 and a molecular weight of 201.27 g/mol. Its IUPAC name is N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide
PubChem CID82506232
Molecular FormulaC9H19N3O2
Molecular Weight201.27 g/mol
Exact Mass201.15
IUPAC NameN-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide
SMILESCCC1CN(C(=O)NCCN)CCO1
InChIInChI=1S/C9H19N3O2/c1-2-8-7-12(5-6-14-8)9(13)11-4-3-10/h8H,2-7,10H2,1H3,(H,11,13)
InChIKeyKPLLZQVVJFQSHD-UHFFFAOYSA-N
XLogP-0.23
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-ethylmorpholine-4-carboxamide
CID 61337795
2-ethylmorpholine-4-carboxylic acid
CID 121455686
(2R)-2-ethyl-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]morpholine-4-carboxamide
CID 97097729
1-[2-[(2-ethylmorpholine-4-carbonyl)amino]ethyl]imidazole-4-carboxylic acid
CID 107496962
1-[[(2-ethylmorpholine-4-carbonyl)amino]methyl]cyclobutane-1-carboxylic acid
CID 113311332
N-(2-aminoethyl)-2-[2-(hydroxymethyl)morpholin-4-yl]-2-oxoacetamide
CID 81206421
(2S)-N-[(5-bromothiophen-3-yl)methyl]-2-ethylmorpholine-4-carboxamide
CID 97097732
2-[4-(3-methylbutylcarbamoyl)morpholin-2-yl]acetic acid
CID 66435211
2-ethyl-N-(4-methylphenyl)morpholine-4-carboxamide
CID 42884313
3-[[2-(hydroxymethyl)morpholine-4-carbonyl]amino]-2-methylpropanoic acid
CID 81204422
2-[4-[3-(dimethylamino)propylcarbamoyl]morpholin-2-yl]acetic acid
CID 66435216
5-[[2-(hydroxymethyl)morpholine-4-carbonyl]amino]-2-methylpentanoic acid
CID 104686844

Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide?
The IUPAC name of N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide (CID 82506232) is N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide?
The canonical SMILES for N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide is CCC1CN(C(=O)NCCN)CCO1.
What is the InChIKey of N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide?
The InChIKey is KPLLZQVVJFQSHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O2/c1-2-8-7-12(5-6-14-8)9(13)11-4-3-10/h8H,2-7,10H2,1H3,(H,11,13).
What are the key properties of N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide?
N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide has a molecular weight of 201.27 g/mol, XLogP of -0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-2-ethylmorpholine-4-carboxamide is sourced from PubChem (CID 82506232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).