N-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine

C15H15N5O — CID 170512498

IUPACN-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine
SMILESCOc1ccnc(Nc2ccc3nc(C)c(C)nc3c2)n1
InChIInChI=1S/C15H15N5O/c1-9-10(2)18-13-8-11(4-5-12(13)17-9)19-15-16-7-6-14(20-15)21-3/h4-8H,1-3H3,(H,16,19,20)
InChIKeyYCSLTAUCBJCQNO-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.79
Rot. Bonds3

About N-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine

N-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine (PubChem CID 170512498) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is N-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine.

Molecular Properties

Compound NameN-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine
PubChem CID170512498
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC NameN-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine
SMILESCOc1ccnc(Nc2ccc3nc(C)c(C)nc3c2)n1
InChIInChI=1S/C15H15N5O/c1-9-10(2)18-13-8-11(4-5-12(13)17-9)19-15-16-7-6-14(20-15)21-3/h4-8H,1-3H3,(H,16,19,20)
InChIKeyYCSLTAUCBJCQNO-UHFFFAOYSA-N
XLogP2.79
TPSA72.82 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-N-(4-methoxypyrimidin-2-yl)benzene-1,4-diamine
CID 63214957
3-N-(4-methoxypyrimidin-2-yl)-1-N-phenylbenzene-1,3-diamine
CID 75413994
2,4-ditert-butyl-N-(4-methoxypyrimidin-2-yl)quinolin-7-amine
CID 153459080
N-(2-methoxy-4-pyridinyl)-4-methylpyrimidin-2-amine
CID 66596222
4-[(4-methoxypyrimidin-2-yl)amino]benzoic acid
CID 43378936
N-[3-(ethoxymethyl)phenyl]-4-methoxypyrimidin-2-amine
CID 133285444
4-methoxy-N-[3-(3,3,3-trifluoropropyl)phenyl]pyrimidin-2-amine
CID 133347689
N-ethyl-4-methoxypyrimidin-2-amine
CID 20510275
4-methoxy-N-(2-methyl-5-nitrophenyl)pyrimidin-2-amine
CID 57435898
N-(4-methoxypyrimidin-2-yl)-N'-propan-2-ylethane-1,2-diamine
CID 62664484
4-[4-(methoxyamino)-3-methylphenoxy]-N-(3-methoxyphenyl)pyrimidin-2-amine
CID 143053924
4-methoxy-N-[3-methyl-5-(6-pentan-3-yl-2-pyridinyl)phenyl]pyrimidin-2-amine
CID 135221220

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine?
The IUPAC name of N-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine (CID 170512498) is N-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine.
What is the SMILES notation for N-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine?
The canonical SMILES for N-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine is COc1ccnc(Nc2ccc3nc(C)c(C)nc3c2)n1.
What is the InChIKey of N-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine?
The InChIKey is YCSLTAUCBJCQNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O/c1-9-10(2)18-13-8-11(4-5-12(13)17-9)19-15-16-7-6-14(20-15)21-3/h4-8H,1-3H3,(H,16,19,20).
What are the key properties of N-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine?
N-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine has a molecular weight of 281.32 g/mol, XLogP of 2.79, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxypyrimidin-2-yl)-2,3-dimethylquinoxalin-6-amine is sourced from PubChem (CID 170512498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).