1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine

C15H24N4 — CID 117212011

IUPAC1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine
SMILESCCc1nc(C2CCC2)ncc1N1CCC(N)CC1
InChIInChI=1S/C15H24N4/c1-2-13-14(19-8-6-12(16)7-9-19)10-17-15(18-13)11-4-3-5-11/h10-12H,2-9,16H2,1H3
InChIKeySZNMDSIPHVLXOB-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.23
Rot. Bonds3

About 1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine

1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine (PubChem CID 117212011) has the molecular formula C15H24N4 and a molecular weight of 260.38 g/mol. Its IUPAC name is 1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine
PubChem CID117212011
Molecular FormulaC15H24N4
Molecular Weight260.38 g/mol
Exact Mass260.20
IUPAC Name1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine
SMILESCCc1nc(C2CCC2)ncc1N1CCC(N)CC1
InChIInChI=1S/C15H24N4/c1-2-13-14(19-8-6-12(16)7-9-19)10-17-15(18-13)11-4-3-5-11/h10-12H,2-9,16H2,1H3
InChIKeySZNMDSIPHVLXOB-UHFFFAOYSA-N
XLogP2.23
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine?
The IUPAC name of 1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine (CID 117212011) is 1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine.
What is the SMILES notation for 1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine?
The canonical SMILES for 1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine is CCc1nc(C2CCC2)ncc1N1CCC(N)CC1.
What is the InChIKey of 1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine?
The InChIKey is SZNMDSIPHVLXOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4/c1-2-13-14(19-8-6-12(16)7-9-19)10-17-15(18-13)11-4-3-5-11/h10-12H,2-9,16H2,1H3.
What are the key properties of 1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine?
1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine has a molecular weight of 260.38 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclobutyl-4-ethylpyrimidin-5-yl)piperidin-4-amine is sourced from PubChem (CID 117212011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).