N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide

C16H25N3O — CID 43266257

IUPACN-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide
SMILESCCC1CCCCN1CC(=O)Nc1ccc(CN)cc1
InChIInChI=1S/C16H25N3O/c1-2-15-5-3-4-10-19(15)12-16(20)18-14-8-6-13(11-17)7-9-14/h6-9,15H,2-5,10-12,17H2,1H3,(H,18,20)
InChIKeyAPUHZIBPTMLBQI-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.35
Rot. Bonds5

About N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide

N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide (PubChem CID 43266257) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide
PubChem CID43266257
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide
SMILESCCC1CCCCN1CC(=O)Nc1ccc(CN)cc1
InChIInChI=1S/C16H25N3O/c1-2-15-5-3-4-10-19(15)12-16(20)18-14-8-6-13(11-17)7-9-14/h6-9,15H,2-5,10-12,17H2,1H3,(H,18,20)
InChIKeyAPUHZIBPTMLBQI-UHFFFAOYSA-N
XLogP2.35
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(aminomethyl)phenyl]-2-(2-propylpiperidin-1-yl)acetamide
CID 83052129
N-(4-acetylphenyl)-2-(2-ethylpiperidin-1-yl)acetamide
CID 109006395
N-(3-aminophenyl)-2-(2-ethylpiperidin-1-yl)acetamide
CID 43266229
2-(2-ethylpiperidin-1-yl)-N-[4-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 109006402
2-[2-(aminomethyl)pyrrolidin-1-yl]-N-(4-propylphenyl)acetamide
CID 81490451
2-[(2S)-2-ethylpiperidin-1-yl]-N-(3-methylphenyl)acetamide
CID 129380241
N-(3,4-difluorophenyl)-2-(2-ethylpiperidin-1-yl)acetamide
CID 42999278
N-[4-(aminomethyl)phenyl]-2-ethylazepane-1-carboxamide
CID 104690862
2-(2-ethylpiperidin-1-yl)-N-(3-iodophenyl)acetamide
CID 47104594
N-[4-(difluoromethylsulfonyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide
CID 51284715
N-[2-(aminomethyl)phenyl]-2-(2-ethylazepan-1-yl)acetamide
CID 104689093
2-[2-(aminomethyl)piperidin-1-yl]-N-phenylacetamide
CID 43186987

Frequently Asked Questions

What is the IUPAC name of N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide?
The IUPAC name of N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide (CID 43266257) is N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide?
The canonical SMILES for N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide is CCC1CCCCN1CC(=O)Nc1ccc(CN)cc1.
What is the InChIKey of N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide?
The InChIKey is APUHZIBPTMLBQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-2-15-5-3-4-10-19(15)12-16(20)18-14-8-6-13(11-17)7-9-14/h6-9,15H,2-5,10-12,17H2,1H3,(H,18,20).
What are the key properties of N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide?
N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide has a molecular weight of 275.40 g/mol, XLogP of 2.35, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(aminomethyl)phenyl]-2-(2-ethylpiperidin-1-yl)acetamide is sourced from PubChem (CID 43266257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).