2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine

C14H26N4 — CID 54167725

IUPAC2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine
SMILESCCC1=NC(N2CCCC(C)C2)=CC(NC)N1C
InChIInChI=1S/C14H26N4/c1-5-12-16-14(9-13(15-3)17(12)4)18-8-6-7-11(2)10-18/h9,11,13,15H,5-8,10H2,1-4H3
InChIKeyOSUZEPGFTNNDQP-UHFFFAOYSA-N
MW250.39 g/mol
LogP1.86
Rot. Bonds3

About 2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine

2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine (PubChem CID 54167725) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine
PubChem CID54167725
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine
SMILESCCC1=NC(N2CCCC(C)C2)=CC(NC)N1C
InChIInChI=1S/C14H26N4/c1-5-12-16-14(9-13(15-3)17(12)4)18-8-6-7-11(2)10-18/h9,11,13,15H,5-8,10H2,1-4H3
InChIKeyOSUZEPGFTNNDQP-UHFFFAOYSA-N
XLogP1.86
TPSA30.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine?
The IUPAC name of 2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine (CID 54167725) is 2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine?
The canonical SMILES for 2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine is CCC1=NC(N2CCCC(C)C2)=CC(NC)N1C.
What is the InChIKey of 2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine?
The InChIKey is OSUZEPGFTNNDQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-5-12-16-14(9-13(15-3)17(12)4)18-8-6-7-11(2)10-18/h9,11,13,15H,5-8,10H2,1-4H3.
What are the key properties of 2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine?
2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine has a molecular weight of 250.39 g/mol, XLogP of 1.86, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N,3-dimethyl-6-(3-methylpiperidin-1-yl)-4H-pyrimidin-4-amine is sourced from PubChem (CID 54167725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).