N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide

C14H17N5O2 — CID 137092384

IUPACN-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide
SMILESCc1cc(C(=O)NCCc2nc(N)cc(=O)[nH]2)cc(C)n1
InChIInChI=1S/C14H17N5O2/c1-8-5-10(6-9(2)17-8)14(21)16-4-3-12-18-11(15)7-13(20)19-12/h5-7H,3-4H2,1-2H3,(H,16,21)(H3,15,18,19,20)
InChIKeyQJOZPXMCZSDPPX-UHFFFAOYSA-N
MW287.32 g/mol
LogP0.34
Rot. Bonds4

About N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide

N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide (PubChem CID 137092384) has the molecular formula C14H17N5O2 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide
PubChem CID137092384
Molecular FormulaC14H17N5O2
Molecular Weight287.32 g/mol
Exact Mass287.14
IUPAC NameN-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide
SMILESCc1cc(C(=O)NCCc2nc(N)cc(=O)[nH]2)cc(C)n1
InChIInChI=1S/C14H17N5O2/c1-8-5-10(6-9(2)17-8)14(21)16-4-3-12-18-11(15)7-13(20)19-12/h5-7H,3-4H2,1-2H3,(H,16,21)(H3,15,18,19,20)
InChIKeyQJOZPXMCZSDPPX-UHFFFAOYSA-N
XLogP0.34
TPSA113.76 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 50.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 137021874
N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-4-(4-methylpiperazin-1-yl)benzamide
CID 136661986
N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)acetamide
CID 137214437
N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-4-propylthiadiazole-5-carboxamide
CID 137108538
3-(dimethylamino)-N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]benzamide
CID 136664785
3-(2-aminoethoxy)-N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]benzamide
CID 136998459
3-(3-fluorophenyl)-N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]benzamide
CID 135990303
N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-5-methyl-1-pyridin-2-ylpyrazole-4-carboxamide
CID 137150738
N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-6-(2-methylpropyl)-2-oxo-1H-pyrimidine-4-carboxamide;formic acid
CID 154909657
(4R)-N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,2-dimethyloxane-4-carboxamide
CID 137108620
2-acetamido-2-methyl-N-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethyl]propanamide
CID 137025351
methyl N-[(2R)-1-[2-(4-methyl-6-oxo-1H-pyrimidin-2-yl)ethylamino]-1-oxopropan-2-yl]carbamate
CID 136867852

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide?
The IUPAC name of N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide (CID 137092384) is N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide.
What is the SMILES notation for N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide?
The canonical SMILES for N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide is Cc1cc(C(=O)NCCc2nc(N)cc(=O)[nH]2)cc(C)n1.
What is the InChIKey of N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide?
The InChIKey is QJOZPXMCZSDPPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O2/c1-8-5-10(6-9(2)17-8)14(21)16-4-3-12-18-11(15)7-13(20)19-12/h5-7H,3-4H2,1-2H3,(H,16,21)(H3,15,18,19,20).
What are the key properties of N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide?
N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 0.34, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-amino-6-oxo-1H-pyrimidin-2-yl)ethyl]-2,6-dimethylpyridine-4-carboxamide is sourced from PubChem (CID 137092384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).