N-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide

C16H24N2O — CID 21041194

IUPACN-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide
SMILESCC(=O)NC(C)C1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C16H24N2O/c1-13(17-14(2)19)16-9-6-10-18(12-16)11-15-7-4-3-5-8-15/h3-5,7-8,13,16H,6,9-12H2,1-2H3,(H,17,19)
InChIKeyCNQLELGTSRJBCC-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.42
Rot. Bonds4

About N-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide

N-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide (PubChem CID 21041194) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is N-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide
PubChem CID21041194
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC NameN-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide
SMILESCC(=O)NC(C)C1CCCN(Cc2ccccc2)C1
InChIInChI=1S/C16H24N2O/c1-13(17-14(2)19)16-9-6-10-18(12-16)11-15-7-4-3-5-8-15/h3-5,7-8,13,16H,6,9-12H2,1-2H3,(H,17,19)
InChIKeyCNQLELGTSRJBCC-UHFFFAOYSA-N
XLogP2.42
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3S)-1-benzylpiperidin-3-yl]acetamide
CID 58526543
(3R)-1-benzyl-N-propan-2-ylpiperidine-3-carboxamide
CID 93490052
2-(1-benzylpiperidin-3-yl)-2-fluoroacetic acid
CID 81358703
N-[(1R)-1-[(3R)-1-benzylpyrrolidin-3-yl]ethyl]-1,3-dithiolane-2-carboxamide
CID 125137166
1-(1-benzylpyrrolidin-3-yl)ethylthiourea
CID 131219663
N-[1-(1-benzylpyrrolidin-3-yl)ethyl]-1-ethylpiperidine-2-carboxamide
CID 154801347
N-[2-[(1-benzylpiperidin-3-yl)amino]ethyl]acetamide
CID 43145152
N-[(1-benzylpiperidin-3-yl)methyl]acetamide
CID 10444612
3-[(1-benzylpiperidin-3-yl)amino]-2-methylbutanoic acid
CID 79396709
1-(1-benzylpiperidin-3-yl)-2-methylpropan-1-one
CID 82384810
(R)-(1-benzylpiperidin-3-yl)-phenylmethanol
CID 146542509
N-(1-benzylpiperidin-3-yl)-2-(propan-2-ylamino)acetamide
CID 64590485

Frequently Asked Questions

What is the IUPAC name of N-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide?
The IUPAC name of N-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide (CID 21041194) is N-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide.
What is the SMILES notation for N-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide?
The canonical SMILES for N-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide is CC(=O)NC(C)C1CCCN(Cc2ccccc2)C1.
What is the InChIKey of N-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide?
The InChIKey is CNQLELGTSRJBCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-13(17-14(2)19)16-9-6-10-18(12-16)11-15-7-4-3-5-8-15/h3-5,7-8,13,16H,6,9-12H2,1-2H3,(H,17,19).
What are the key properties of N-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide?
N-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide has a molecular weight of 260.38 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1-benzylpiperidin-3-yl)ethyl]acetamide is sourced from PubChem (CID 21041194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).