2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride

C12H16ClN5O — CID 120622901

IUPAC2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride
SMILESCl.Cn1nccc1CNC(=O)Cc1ccc(N)cn1
InChIInChI=1S/C12H15N5O.ClH/c1-17-11(4-5-16-17)8-15-12(18)6-10-3-2-9(13)7-14-10;/h2-5,7H,6,8,13H2,1H3,(H,15,18);1H
InChIKeyOSVKLZMGVMDCGJ-UHFFFAOYSA-N
MW281.75 g/mol
LogP0.68
Rot. Bonds4

About 2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride

2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride (PubChem CID 120622901) has the molecular formula C12H16ClN5O and a molecular weight of 281.75 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride
PubChem CID120622901
Molecular FormulaC12H16ClN5O
Molecular Weight281.75 g/mol
Exact Mass281.10
IUPAC Name2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride
SMILESCl.Cn1nccc1CNC(=O)Cc1ccc(N)cn1
InChIInChI=1S/C12H15N5O.ClH/c1-17-11(4-5-16-17)8-15-12(18)6-10-3-2-9(13)7-14-10;/h2-5,7H,6,8,13H2,1H3,(H,15,18);1H
InChIKeyOSVKLZMGVMDCGJ-UHFFFAOYSA-N
XLogP0.68
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.75
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-aminophenyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide
CID 63304660
2-amino-N-[(2-methylpyrazol-3-yl)methyl]acetamide
CID 63302579
2-(5-amino-2-pyridinyl)-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide;hydrochloride
CID 120618498
2-(5-amino-2-pyridinyl)-N-(2-methoxyethyl)acetamide
CID 107337331
2-(5-amino-2-pyridinyl)-N-(2,2-difluoroethyl)acetamide;hydrochloride
CID 120632231
3-amino-3-methyl-N-[(2-methylpyrazol-3-yl)methyl]butanamide
CID 64678263
N-[(2-methylpyrazol-3-yl)methyl]acetamide
CID 19292671
3-(2-aminophenyl)-N-[(2-methylpyrazol-3-yl)methyl]propanamide
CID 63303724
4-amino-2-fluoro-N-[(2-methylpyrazol-3-yl)methyl]benzamide
CID 55205164
2-(5-amino-2-pyridinyl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 107337362
4-amino-1-methyl-N-[(2-methylpyrazol-3-yl)methyl]pyrrole-2-carboxamide
CID 63304317
3-amino-N-[(2-methylpyrazol-3-yl)methyl]benzamide
CID 63304139

Frequently Asked Questions

What is the IUPAC name of 2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride?
The IUPAC name of 2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride (CID 120622901) is 2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride?
The canonical SMILES for 2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride is Cl.Cn1nccc1CNC(=O)Cc1ccc(N)cn1.
What is the InChIKey of 2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride?
The InChIKey is OSVKLZMGVMDCGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O.ClH/c1-17-11(4-5-16-17)8-15-12(18)6-10-3-2-9(13)7-14-10;/h2-5,7H,6,8,13H2,1H3,(H,15,18);1H.
What are the key properties of 2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride?
2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride has a molecular weight of 281.75 g/mol, XLogP of 0.68, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-amino-2-pyridinyl)-N-[(2-methylpyrazol-3-yl)methyl]acetamide;hydrochloride is sourced from PubChem (CID 120622901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).