2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine

C12H13N3O — CID 83886658

IUPAC2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine
SMILESCNc1cnc(-c2cccc(OC)c2)nc1
InChIInChI=1S/C12H13N3O/c1-13-10-7-14-12(15-8-10)9-4-3-5-11(6-9)16-2/h3-8,13H,1-2H3
InChIKeyUUNQNDNPTSVQPK-UHFFFAOYSA-N
MW215.26 g/mol
LogP2.19
Rot. Bonds3

About 2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine

2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine (PubChem CID 83886658) has the molecular formula C12H13N3O and a molecular weight of 215.26 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine
PubChem CID83886658
Molecular FormulaC12H13N3O
Molecular Weight215.26 g/mol
Exact Mass215.11
IUPAC Name2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine
SMILESCNc1cnc(-c2cccc(OC)c2)nc1
InChIInChI=1S/C12H13N3O/c1-13-10-7-14-12(15-8-10)9-4-3-5-11(6-9)16-2/h3-8,13H,1-2H3
InChIKeyUUNQNDNPTSVQPK-UHFFFAOYSA-N
XLogP2.19
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methoxyphenyl)-5-methylpyrimidine
CID 121432653
N'-[2-(3-methoxyphenyl)pyrimidin-5-yl]ethane-1,2-diamine
CID 117212327
5-(2-methoxyphenoxy)-2-(3-methoxyphenyl)pyrimidine
CID 150700013
1-[2-(3-methoxyphenyl)pyrimidin-5-yl]oxy-N-methylpropan-2-amine
CID 117231190
2-[2-(3-methoxyphenyl)pyrimidin-5-yl]oxyethanol
CID 117230603
2-(3-methoxyphenyl)-N-methylpyrimidin-4-amine
CID 62191311
4-(5-methoxypyrimidin-2-yl)-N-methylaniline
CID 156821520
N-[[2-(3-methoxyphenyl)pyrimidin-5-yl]methyl]cyclopropanamine
CID 62755519
2-(3-methoxyphenyl)-4-methylpyrimidine-5-carbaldehyde
CID 82288198
5-methoxy-2-(3-methylphenyl)pyrimidine
CID 91581567
3-(3-methoxyphenyl)-N-methyl-1,2,4-thiadiazol-5-amine
CID 65268854
1-methoxy-3-(3-methoxyphenyl)benzene;sulfane
CID 175169762

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine?
The IUPAC name of 2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine (CID 83886658) is 2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine.
What is the SMILES notation for 2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine?
The canonical SMILES for 2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine is CNc1cnc(-c2cccc(OC)c2)nc1.
What is the InChIKey of 2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine?
The InChIKey is UUNQNDNPTSVQPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O/c1-13-10-7-14-12(15-8-10)9-4-3-5-11(6-9)16-2/h3-8,13H,1-2H3.
What are the key properties of 2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine?
2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine has a molecular weight of 215.26 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-N-methylpyrimidin-5-amine is sourced from PubChem (CID 83886658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).