5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine

C14H18N4O — CID 51042022

IUPAC5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine
SMILESCOc1cnc(-c2ccccn2)nc1N(C)C(C)C
InChIInChI=1S/C14H18N4O/c1-10(2)18(3)14-12(19-4)9-16-13(17-14)11-7-5-6-8-15-11/h5-10H,1-4H3
InChIKeyPFSADRKLQBMTGW-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.39
Rot. Bonds4

About 5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine

5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine (PubChem CID 51042022) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound Name5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine
PubChem CID51042022
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine
SMILESCOc1cnc(-c2ccccn2)nc1N(C)C(C)C
InChIInChI=1S/C14H18N4O/c1-10(2)18(3)14-12(19-4)9-16-13(17-14)11-7-5-6-8-15-11/h5-10H,1-4H3
InChIKeyPFSADRKLQBMTGW-UHFFFAOYSA-N
XLogP2.39
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine?
The IUPAC name of 5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine (CID 51042022) is 5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine.
What is the SMILES notation for 5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine?
The canonical SMILES for 5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine is COc1cnc(-c2ccccn2)nc1N(C)C(C)C.
What is the InChIKey of 5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine?
The InChIKey is PFSADRKLQBMTGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-10(2)18(3)14-12(19-4)9-16-13(17-14)11-7-5-6-8-15-11/h5-10H,1-4H3.
What are the key properties of 5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine?
5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine has a molecular weight of 258.32 g/mol, XLogP of 2.39, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-methyl-N-propan-2-yl-2-pyridin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 51042022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).