2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide

C14H21N3O — CID 43186987

IUPAC2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide
SMILESNCC1CCCCN1CC(=O)Nc1ccccc1
InChIInChI=1S/C14H21N3O/c15-10-13-8-4-5-9-17(13)11-14(18)16-12-6-2-1-3-7-12/h1-3,6-7,13H,4-5,8-11,15H2,(H,16,18)
InChIKeyKWRDFKQFFDTFLE-UHFFFAOYSA-N
MW247.34 g/mol
LogP1.44
Rot. Bonds4

About 2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide

2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide (PubChem CID 43186987) has the molecular formula C14H21N3O and a molecular weight of 247.34 g/mol. Its IUPAC name is 2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide
PubChem CID43186987
Molecular FormulaC14H21N3O
Molecular Weight247.34 g/mol
Exact Mass247.17
IUPAC Name2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide
SMILESNCC1CCCCN1CC(=O)Nc1ccccc1
InChIInChI=1S/C14H21N3O/c15-10-13-8-4-5-9-17(13)11-14(18)16-12-6-2-1-3-7-12/h1-3,6-7,13H,4-5,8-11,15H2,(H,16,18)
InChIKeyKWRDFKQFFDTFLE-UHFFFAOYSA-N
XLogP1.44
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(aminomethyl)azepan-1-yl]-N-(3-methoxyphenyl)acetamide
CID 116640393
2-[2-(aminomethyl)piperidin-1-yl]-N-(2-iodophenyl)acetamide;hydrochloride
CID 119916158
1-(2-anilino-2-oxoethyl)piperidine-2-carboxylic acid
CID 43441072
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-(4-propylphenyl)acetamide
CID 81490451
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-(3-ethylphenyl)acetamide;hydrochloride
CID 119927202
N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide
CID 43266257
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-(3,5-difluorophenyl)acetamide;hydrochloride
CID 119926972
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-benzylacetamide;hydrochloride
CID 119927076
N-phenyl-2-(2-phenylpyrrolidin-1-yl)acetamide
CID 18137699
N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide
CID 43266229
2-[1-[2-(4-bromoanilino)-2-oxoethyl]piperidin-2-yl]acetic acid
CID 61010278
N-[4-(aminomethyl)phenyl]-2-(2-propylpiperidin-1-yl)acetamide
CID 83052129

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide?
The IUPAC name of 2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide (CID 43186987) is 2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide.
What is the SMILES notation for 2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide?
The canonical SMILES for 2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide is NCC1CCCCN1CC(=O)Nc1ccccc1.
What is the InChIKey of 2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide?
The InChIKey is KWRDFKQFFDTFLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O/c15-10-13-8-4-5-9-17(13)11-14(18)16-12-6-2-1-3-7-12/h1-3,6-7,13H,4-5,8-11,15H2,(H,16,18).
What are the key properties of 2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide?
2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide has a molecular weight of 247.34 g/mol, XLogP of 1.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide is sourced from PubChem (CID 43186987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).