N-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride

C12H14ClN5O — CID 170731029

IUPACN-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride
SMILESCC(=O)Nc1cc(N)c(-c2cc(C)ncn2)cn1.Cl
InChIInChI=1S/C12H13N5O.ClH/c1-7-3-11(16-6-15-7)9-5-14-12(4-10(9)13)17-8(2)18;/h3-6H,1-2H3,(H3,13,14,17,18);1H
InChIKeyFELWVZGYNMPOTJ-UHFFFAOYSA-N
MW279.73 g/mol
LogP1.81
Rot. Bonds2

About N-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride

N-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride (PubChem CID 170731029) has the molecular formula C12H14ClN5O and a molecular weight of 279.73 g/mol. Its IUPAC name is N-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride.

Molecular Properties

Compound NameN-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride
PubChem CID170731029
Molecular FormulaC12H14ClN5O
Molecular Weight279.73 g/mol
Exact Mass279.09
IUPAC NameN-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride
SMILESCC(=O)Nc1cc(N)c(-c2cc(C)ncn2)cn1.Cl
InChIInChI=1S/C12H13N5O.ClH/c1-7-3-11(16-6-15-7)9-5-14-12(4-10(9)13)17-8(2)18;/h3-6H,1-2H3,(H3,13,14,17,18);1H
InChIKeyFELWVZGYNMPOTJ-UHFFFAOYSA-N
XLogP1.81
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.73
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride?
The IUPAC name of N-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride (CID 170731029) is N-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride.
What is the SMILES notation for N-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride?
The canonical SMILES for N-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride is CC(=O)Nc1cc(N)c(-c2cc(C)ncn2)cn1.Cl.
What is the InChIKey of N-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride?
The InChIKey is FELWVZGYNMPOTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N5O.ClH/c1-7-3-11(16-6-15-7)9-5-14-12(4-10(9)13)17-8(2)18;/h3-6H,1-2H3,(H3,13,14,17,18);1H.
What are the key properties of N-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride?
N-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride has a molecular weight of 279.73 g/mol, XLogP of 1.81, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-amino-5-(6-methylpyrimidin-4-yl)-2-pyridinyl]acetamide;hydrochloride is sourced from PubChem (CID 170731029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).