N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine

C18H21N5O — CID 133291035

IUPACN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine
SMILESCCc1cc(N(C)Cc2c(C)noc2C)nc(-c2ccccn2)n1
InChIInChI=1S/C18H21N5O/c1-5-14-10-17(21-18(20-14)16-8-6-7-9-19-16)23(4)11-15-12(2)22-24-13(15)3/h6-10H,5,11H2,1-4H3
InChIKeyIVSBMMXAZAYRNA-UHFFFAOYSA-N
MW323.40 g/mol
LogP3.34
Rot. Bonds5

About N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine

N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine (PubChem CID 133291035) has the molecular formula C18H21N5O and a molecular weight of 323.40 g/mol. Its IUPAC name is N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine
PubChem CID133291035
Molecular FormulaC18H21N5O
Molecular Weight323.40 g/mol
Exact Mass323.17
IUPAC NameN-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine
SMILESCCc1cc(N(C)Cc2c(C)noc2C)nc(-c2ccccn2)n1
InChIInChI=1S/C18H21N5O/c1-5-14-10-17(21-18(20-14)16-8-6-7-9-19-16)23(4)11-15-12(2)22-24-13(15)3/h6-10H,5,11H2,1-4H3
InChIKeyIVSBMMXAZAYRNA-UHFFFAOYSA-N
XLogP3.34
TPSA67.94 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)-methylamino]methyl]benzonitrile
CID 133290956
N-(2-cyclopropylethyl)-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine
CID 133398408
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-methyl-1-pyridin-2-ylmethanamine
CID 171328140
3-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)-(2-hydroxyethyl)amino]propan-1-ol
CID 111464683
6-(2-aminoethyl)-N,N-dimethyl-2-pyridin-2-ylpyrimidin-4-amine
CID 51598656
5-[[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)amino]methyl]-N,N-dimethyl-1,2,4-oxadiazol-3-amine
CID 133487610
6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine
CID 62191102
(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methanamine
CID 28916463
N-(3-ethoxy-2,2-dimethylcyclobutyl)-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine
CID 102557991
N-[2-[(6-ethyl-2-pyridin-2-ylpyrimidin-4-yl)-propan-2-ylamino]ethyl]acetamide
CID 86795811
N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-N,5,6-trimethyl-2-pyridin-2-ylpyrimidin-4-amine
CID 56584826
N-[(4,6-dimethyl-2-pyridin-2-ylpyrimidin-5-yl)methyl]ethanamine
CID 62744443

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine?
The IUPAC name of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine (CID 133291035) is N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine.
What is the SMILES notation for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine?
The canonical SMILES for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine is CCc1cc(N(C)Cc2c(C)noc2C)nc(-c2ccccn2)n1.
What is the InChIKey of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine?
The InChIKey is IVSBMMXAZAYRNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N5O/c1-5-14-10-17(21-18(20-14)16-8-6-7-9-19-16)23(4)11-15-12(2)22-24-13(15)3/h6-10H,5,11H2,1-4H3.
What are the key properties of N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine?
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine has a molecular weight of 323.40 g/mol, XLogP of 3.34, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-6-ethyl-N-methyl-2-pyridin-2-ylpyrimidin-4-amine is sourced from PubChem (CID 133291035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).