2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide

C14H24N2O2 — CID 11912296

IUPAC2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide
SMILESCC[C@H]1CN(C(C)=O)CC[C@H]1CC(=O)NC1CC1
InChIInChI=1S/C14H24N2O2/c1-3-11-9-16(10(2)17)7-6-12(11)8-14(18)15-13-4-5-13/h11-13H,3-9H2,1-2H3,(H,15,18)/t11-,12-/m0/s1
InChIKeyCUIHADSGSUXFNZ-RYUDHWBXSA-N
MW252.36 g/mol
LogP1.55
Rot. Bonds4

About 2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide

2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide (PubChem CID 11912296) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide
PubChem CID11912296
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide
SMILESCC[C@H]1CN(C(C)=O)CC[C@H]1CC(=O)NC1CC1
InChIInChI=1S/C14H24N2O2/c1-3-11-9-16(10(2)17)7-6-12(11)8-14(18)15-13-4-5-13/h11-13H,3-9H2,1-2H3,(H,15,18)/t11-,12-/m0/s1
InChIKeyCUIHADSGSUXFNZ-RYUDHWBXSA-N
XLogP1.55
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclohexylacetamide
CID 40587829
2-(1-acetyl-3-ethylpiperidin-4-yl)-N-propylacetamide
CID 73139163
N-cyclopropyl-2-[3-ethyl-1-(4-fluorobenzoyl)piperidin-4-yl]acetamide
CID 73139183
2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-(2-piperidin-1-ylethyl)acetamide
CID 11913147
2-[(3R,4S)-1-benzoyl-3-ethylpiperidin-4-yl]-N-cyclohexylacetamide
CID 11912038
2-[(3S,4S)-1-benzoyl-3-ethylpiperidin-4-yl]-N-cyclohexylacetamide
CID 162804419
(3S,4S)-4-[2-(cyclopropylamino)-2-oxoethyl]-3-ethyl-N-[3-(trifluoromethyl)phenyl]piperidine-1-carboxamide
CID 162904175
4-[2-(cyclopropylamino)-2-oxoethyl]-3-ethyl-N-[3-(trifluoromethyl)phenyl]piperidine-1-carboxamide
CID 73139265
2-[(1-acetylpiperidin-4-yl)amino]-N-cyclopropylacetamide
CID 43231891
N-(1-acetylpyrrolidin-3-yl)pentanamide
CID 110871326
N-(1-acetylpiperidin-4-yl)-2-(1-aminocyclobutyl)acetamide
CID 79854676
N-(1-acetylpiperidin-4-yl)acetamide
CID 23402928

Frequently Asked Questions

What is the IUPAC name of 2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide?
The IUPAC name of 2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide (CID 11912296) is 2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide?
The canonical SMILES for 2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide is CC[C@H]1CN(C(C)=O)CC[C@H]1CC(=O)NC1CC1.
What is the InChIKey of 2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide?
The InChIKey is CUIHADSGSUXFNZ-RYUDHWBXSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-3-11-9-16(10(2)17)7-6-12(11)8-14(18)15-13-4-5-13/h11-13H,3-9H2,1-2H3,(H,15,18)/t11-,12-/m0/s1.
What are the key properties of 2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide?
2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide has a molecular weight of 252.36 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3R,4S)-1-acetyl-3-ethylpiperidin-4-yl]-N-cyclopropylacetamide is sourced from PubChem (CID 11912296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).