N,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine

C14H18N4O — CID 51042018

IUPACN,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine
SMILESCCN(CC)c1nc(-c2ccccn2)ncc1OC
InChIInChI=1S/C14H18N4O/c1-4-18(5-2)14-12(19-3)10-16-13(17-14)11-8-6-7-9-15-11/h6-10H,4-5H2,1-3H3
InChIKeyGVFLLMIGCSFGMT-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.39
Rot. Bonds5

About N,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine

N,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine (PubChem CID 51042018) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is N,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine
PubChem CID51042018
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC NameN,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine
SMILESCCN(CC)c1nc(-c2ccccn2)ncc1OC
InChIInChI=1S/C14H18N4O/c1-4-18(5-2)14-12(19-3)10-16-13(17-14)11-8-6-7-9-15-11/h6-10H,4-5H2,1-3H3
InChIKeyGVFLLMIGCSFGMT-UHFFFAOYSA-N
XLogP2.39
TPSA51.14 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
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 N,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine?
The IUPAC name of N,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine (CID 51042018) is N,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine.
What is the SMILES notation for N,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine?
The canonical SMILES for N,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine is CCN(CC)c1nc(-c2ccccn2)ncc1OC.
What is the InChIKey of N,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine?
The InChIKey is GVFLLMIGCSFGMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-4-18(5-2)14-12(19-3)10-16-13(17-14)11-8-6-7-9-15-11/h6-10H,4-5H2,1-3H3.
What are the key properties of N,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine?
N,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine has a molecular weight of 258.32 g/mol, XLogP of 2.39, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-5-methoxy-2-pyridin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 51042018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).