N-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide

C18H34N4O3 — CID 11912031

IUPACN-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide
SMILESCC[C@H]1CN(C(=O)N2CCOCC2)CC[C@H]1CC(=O)NCCN(C)C
InChIInChI=1S/C18H34N4O3/c1-4-15-14-22(18(24)21-9-11-25-12-10-21)7-5-16(15)13-17(23)19-6-8-20(2)3/h15-16H,4-14H2,1-3H3,(H,19,23)/t15-,16-/m0/s1
InChIKeyDYIANAGXBZJLBN-HOTGVXAUSA-N
MW354.50 g/mol
LogP0.85
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide

N-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide (PubChem CID 11912031) has the molecular formula C18H34N4O3 and a molecular weight of 354.50 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide
PubChem CID11912031
Molecular FormulaC18H34N4O3
Molecular Weight354.50 g/mol
Exact Mass354.26
IUPAC NameN-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide
SMILESCC[C@H]1CN(C(=O)N2CCOCC2)CC[C@H]1CC(=O)NCCN(C)C
InChIInChI=1S/C18H34N4O3/c1-4-15-14-22(18(24)21-9-11-25-12-10-21)7-5-16(15)13-17(23)19-6-8-20(2)3/h15-16H,4-14H2,1-3H3,(H,19,23)/t15-,16-/m0/s1
InChIKeyDYIANAGXBZJLBN-HOTGVXAUSA-N
XLogP0.85
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.50
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylamino)ethyl]-2-[3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide
CID 73138916
2-[3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]-N-prop-2-ynylacetamide
CID 73139171
2-[3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]-N-[(2-methoxyphenyl)methyl]acetamide
CID 73139173
2-(1-acetyl-3-ethylpiperidin-4-yl)-N-propylacetamide
CID 73139163
2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-(2-piperidin-1-ylethyl)acetamide
CID 11913147
2-[(3S,4S)-3-ethyl-1-(pyridine-3-carbonyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)acetamide
CID 162806846
[4-[2-(dimethylamino)ethyl]-3,5-dimethylpiperazin-1-yl]-morpholin-4-ylmethanone
CID 110290389
2-[(3R,4S)-1-(2,2-dimethylpropanoyl)-3-ethylpiperidin-4-yl]-N-(2-piperidin-1-ylethyl)acetamide
CID 11941189
N-[2-(dimethylamino)ethyl]-2-[(1S,2S)-2-propanoylcyclohexyl]acetamide
CID 143839933
N-[3-(dimethylamino)propyl]morpholine-4-carboxamide
CID 3255795
2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide
CID 11912296
N-[2-(dimethylamino)ethyl]-4-(2-morpholin-4-ylethyl)piperazine-1-carboxamide
CID 113105782

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide (CID 11912031) is N-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide is CC[C@H]1CN(C(=O)N2CCOCC2)CC[C@H]1CC(=O)NCCN(C)C.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide?
The InChIKey is DYIANAGXBZJLBN-HOTGVXAUSA-N. The full InChI is InChI=1S/C18H34N4O3/c1-4-15-14-22(18(24)21-9-11-25-12-10-21)7-5-16(15)13-17(23)19-6-8-20(2)3/h15-16H,4-14H2,1-3H3,(H,19,23)/t15-,16-/m0/s1.
What are the key properties of N-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide?
N-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide has a molecular weight of 354.50 g/mol, XLogP of 0.85, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-[(3R,4S)-3-ethyl-1-(morpholine-4-carbonyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 11912031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).