2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide

C18H29N3O — CID 119927919

IUPAC2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide
SMILESCCNCC1CCN(CC(=O)Nc2ccc(CC)cc2)CC1
InChIInChI=1S/C18H29N3O/c1-3-15-5-7-17(8-6-15)20-18(22)14-21-11-9-16(10-12-21)13-19-4-2/h5-8,16,19H,3-4,9-14H2,1-2H3,(H,20,22)
InChIKeyHNJFVHAIPGAYSL-UHFFFAOYSA-N
MW303.45 g/mol
LogP2.51
Rot. Bonds7

About 2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide

2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide (PubChem CID 119927919) has the molecular formula C18H29N3O and a molecular weight of 303.45 g/mol. Its IUPAC name is 2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide
PubChem CID119927919
Molecular FormulaC18H29N3O
Molecular Weight303.45 g/mol
Exact Mass303.23
IUPAC Name2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide
SMILESCCNCC1CCN(CC(=O)Nc2ccc(CC)cc2)CC1
InChIInChI=1S/C18H29N3O/c1-3-15-5-7-17(8-6-15)20-18(22)14-21-11-9-16(10-12-21)13-19-4-2/h5-8,16,19H,3-4,9-14H2,1-2H3,(H,20,22)
InChIKeyHNJFVHAIPGAYSL-UHFFFAOYSA-N
XLogP2.51
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.45
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(cyclopropylmethylamino)piperidin-1-yl]-N-(4-ethylphenyl)acetamide
CID 119926462
2-(4-benzylpiperidin-1-yl)-N-(4-ethylphenyl)acetamide
CID 17380707
2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(3-fluorophenyl)acetamide;hydrochloride
CID 119928163
2-(4-acetamidopiperidin-1-yl)-N-(4-ethylphenyl)acetamide
CID 3220742
N-(3-chlorophenyl)-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide
CID 63848226
N-(4-ethylphenyl)-2-(4-propylpiperazin-1-yl)acetamide
CID 22196973
2-[1-[2-(4-ethylanilino)-2-oxoethyl]azetidin-3-yl]acetic acid
CID 64616490
2-[4-[(2-ethylimidazol-1-yl)methyl]piperidin-1-yl]-N-(4-ethylphenyl)acetamide
CID 90493958
N-(4-bromophenyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
CID 63248697
2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(2-ethyl-6-methylphenyl)acetamide;hydrochloride
CID 119928048
1-[2-(3,4-dimethylanilino)-2-oxoethyl]-N-(4-ethylphenyl)piperidine-4-carboxamide
CID 16909824
N-[4-(aminomethyl)phenyl]-2-[4-(hydroxymethyl)piperidin-1-yl]acetamide
CID 43246107

Frequently Asked Questions

What is the IUPAC name of 2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide?
The IUPAC name of 2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide (CID 119927919) is 2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide.
What is the SMILES notation for 2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide?
The canonical SMILES for 2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide is CCNCC1CCN(CC(=O)Nc2ccc(CC)cc2)CC1.
What is the InChIKey of 2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide?
The InChIKey is HNJFVHAIPGAYSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O/c1-3-15-5-7-17(8-6-15)20-18(22)14-21-11-9-16(10-12-21)13-19-4-2/h5-8,16,19H,3-4,9-14H2,1-2H3,(H,20,22).
What are the key properties of 2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide?
2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide has a molecular weight of 303.45 g/mol, XLogP of 2.51, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(ethylaminomethyl)piperidin-1-yl]-N-(4-ethylphenyl)acetamide is sourced from PubChem (CID 119927919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).