N-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine

C14H18N4 — CID 80952838

IUPACN-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine
SMILESCCNc1cc(-c2ccncc2)nc(C(C)C)n1
InChIInChI=1S/C14H18N4/c1-4-16-13-9-12(11-5-7-15-8-6-11)17-14(18-13)10(2)3/h5-10H,4H2,1-3H3,(H,16,17,18)
InChIKeyRHMLOOCHVNAZBM-UHFFFAOYSA-N
MW242.33 g/mol
LogP3.09
Rot. Bonds4

About N-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine

N-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine (PubChem CID 80952838) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is N-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound NameN-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine
PubChem CID80952838
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC NameN-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine
SMILESCCNc1cc(-c2ccncc2)nc(C(C)C)n1
InChIInChI=1S/C14H18N4/c1-4-16-13-9-12(11-5-7-15-8-6-11)17-14(18-13)10(2)3/h5-10H,4H2,1-3H3,(H,16,17,18)
InChIKeyRHMLOOCHVNAZBM-UHFFFAOYSA-N
XLogP3.09
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-6-(3-methyl-4-pyridinyl)-2-propan-2-ylpyrimidin-4-amine
CID 80952791
6-(4-methylphenyl)-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80952017
N-ethyl-2-propan-2-yl-6-(2,4,5-trimethylphenyl)pyrimidin-4-amine
CID 80948151
6-(2,3-difluoro-4-methylphenyl)-N-ethyl-2-propan-2-ylpyrimidin-4-amine
CID 107514561
6-(4-methoxyphenyl)-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80949110
N-ethyl-2-propan-2-yl-6-propylpyrimidin-4-amine
CID 62192677
N-ethyl-2,6-di(propan-2-yl)pyrimidin-4-amine
CID 62191637
6-N-ethyl-4-N-[(4-methyl-3-pyridinyl)methyl]-2-propan-2-ylpyrimidine-4,6-diamine
CID 114957968
N-ethyl-2-propan-2-yl-6-propan-2-ylsulfanylpyrimidin-4-amine
CID 80962750
6-N-ethyl-4-N-[(4-methylphenyl)methyl]-2-propan-2-ylpyrimidine-4,6-diamine
CID 80960320
6-(2-chloro-5-fluorophenyl)-N-ethyl-2-propan-2-ylpyrimidin-4-amine
CID 105396158
6-(4-methyl-3-pyridinyl)-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80952057

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine?
The IUPAC name of N-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine (CID 80952838) is N-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine.
What is the SMILES notation for N-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine?
The canonical SMILES for N-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine is CCNc1cc(-c2ccncc2)nc(C(C)C)n1.
What is the InChIKey of N-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine?
The InChIKey is RHMLOOCHVNAZBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c1-4-16-13-9-12(11-5-7-15-8-6-11)17-14(18-13)10(2)3/h5-10H,4H2,1-3H3,(H,16,17,18).
What are the key properties of N-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine?
N-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine has a molecular weight of 242.33 g/mol, XLogP of 3.09, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-propan-2-yl-6-pyridin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 80952838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).