2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride

C16H18ClN3O2 — CID 120623696

IUPAC2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride
SMILESCl.Nc1ccc(CC(=O)NC2COc3ccccc3C2)nc1
InChIInChI=1S/C16H17N3O2.ClH/c17-12-5-6-13(18-9-12)8-16(20)19-14-7-11-3-1-2-4-15(11)21-10-14;/h1-6,9,14H,7-8,10,17H2,(H,19,20);1H
InChIKeyAIJCDXNWPXRFGQ-UHFFFAOYSA-N
MW319.79 g/mol
LogP1.75
Rot. Bonds3

About 2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride

2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride (PubChem CID 120623696) has the molecular formula C16H18ClN3O2 and a molecular weight of 319.79 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride
PubChem CID120623696
Molecular FormulaC16H18ClN3O2
Molecular Weight319.79 g/mol
Exact Mass319.11
IUPAC Name2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride
SMILESCl.Nc1ccc(CC(=O)NC2COc3ccccc3C2)nc1
InChIInChI=1S/C16H17N3O2.ClH/c17-12-5-6-13(18-9-12)8-16(20)19-14-7-11-3-1-2-4-15(11)21-10-14;/h1-6,9,14H,7-8,10,17H2,(H,19,20);1H
InChIKeyAIJCDXNWPXRFGQ-UHFFFAOYSA-N
XLogP1.75
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.79
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-amino-2-pyridinyl)-N-(oxolan-3-yl)acetamide
CID 107339286
N-[(3S)-3,4-dihydro-2H-chromen-3-yl]-3-methylbutanamide
CID 94466633
3-amino-N-[(3S)-3,4-dihydro-2H-chromen-3-yl]pyrazine-2-carboxamide
CID 94066552
N-(3,4-dihydro-2H-chromen-3-yl)-4-(methylamino)butanamide;hydrochloride
CID 119734025
3-amino-N-(3,4-dihydro-2H-chromen-3-yl)pyrazine-2-carboxamide
CID 102556079
methyl 4-(3,4-dihydro-2H-chromen-3-ylamino)-4-oxobutanoate
CID 110751478
2-(5-amino-2-pyridinyl)-N-(1-pyridin-2-ylpiperidin-4-yl)acetamide;dihydrochloride
CID 120643499
4-[[2-(5-amino-2-pyridinyl)acetyl]amino]cyclohexane-1-carboxamide
CID 107337718
N-[(3R)-3,4-dihydro-2H-chromen-3-yl]-2-(methanesulfonamido)acetamide
CID 129368199
N-(3,4-dihydro-2H-chromen-3-yl)-2-(2-methylphenoxy)acetamide
CID 110751539
N-[(3R)-3,4-dihydro-2H-chromen-3-yl]benzamide
CID 93499192
2-amino-N-(3,4-dihydro-2H-chromen-3-yl)pentanamide;hydrochloride
CID 119295204

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride (CID 120623696) is 2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride is Cl.Nc1ccc(CC(=O)NC2COc3ccccc3C2)nc1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride?
The InChIKey is AIJCDXNWPXRFGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2.ClH/c17-12-5-6-13(18-9-12)8-16(20)19-14-7-11-3-1-2-4-15(11)21-10-14;/h1-6,9,14H,7-8,10,17H2,(H,19,20);1H.
What are the key properties of 2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride?
2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride has a molecular weight of 319.79 g/mol, XLogP of 1.75, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-(3,4-dihydro-2H-chromen-3-yl)acetamide;hydrochloride is sourced from PubChem (CID 120623696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).