2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride

C16H24ClN3O2 — CID 119907719

IUPAC2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride
SMILESCl.NC1CCN(CC(=O)NC2CCOc3ccccc32)CC1
InChIInChI=1S/C16H23N3O2.ClH/c17-12-5-8-19(9-6-12)11-16(20)18-14-7-10-21-15-4-2-1-3-13(14)15;/h1-4,12,14H,5-11,17H2,(H,18,20);1H
InChIKeyARBWKJUEQVWJGI-UHFFFAOYSA-N
MW325.84 g/mol
LogP1.47
Rot. Bonds3

About 2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride

2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride (PubChem CID 119907719) has the molecular formula C16H24ClN3O2 and a molecular weight of 325.84 g/mol. Its IUPAC name is 2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride
PubChem CID119907719
Molecular FormulaC16H24ClN3O2
Molecular Weight325.84 g/mol
Exact Mass325.16
IUPAC Name2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride
SMILESCl.NC1CCN(CC(=O)NC2CCOc3ccccc32)CC1
InChIInChI=1S/C16H23N3O2.ClH/c17-12-5-8-19(9-6-12)11-16(20)18-14-7-10-21-15-4-2-1-3-13(14)15;/h1-4,12,14H,5-11,17H2,(H,18,20);1H
InChIKeyARBWKJUEQVWJGI-UHFFFAOYSA-N
XLogP1.47
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.84
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 79328345
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CID 124703387
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CID 97090833
N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-(4,4-dimethyl-1,3-dihydroisoquinolin-2-yl)acetamide
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CID 95630096
2-(benzotriazol-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide
CID 18193012
5-(3,4-dihydro-2H-chromen-4-ylamino)-5-oxopentanoic acid
CID 43580055
4-chloro-N-(3,4-dihydro-2H-chromen-4-yl)butanamide
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Frequently Asked Questions

What is the IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride?
The IUPAC name of 2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride (CID 119907719) is 2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride?
The canonical SMILES for 2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride is Cl.NC1CCN(CC(=O)NC2CCOc3ccccc32)CC1.
What is the InChIKey of 2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride?
The InChIKey is ARBWKJUEQVWJGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2.ClH/c17-12-5-8-19(9-6-12)11-16(20)18-14-7-10-21-15-4-2-1-3-13(14)15;/h1-4,12,14H,5-11,17H2,(H,18,20);1H.
What are the key properties of 2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride?
2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride has a molecular weight of 325.84 g/mol, XLogP of 1.47, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminopiperidin-1-yl)-N-(3,4-dihydro-2H-chromen-4-yl)acetamide;hydrochloride is sourced from PubChem (CID 119907719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).