5-(2-ethylpyrrolidin-2-yl)pyrimidine

C10H15N3 — CID 66466456

IUPAC5-(2-ethylpyrrolidin-2-yl)pyrimidine
SMILESCCC1(c2cncnc2)CCCN1
InChIInChI=1S/C10H15N3/c1-2-10(4-3-5-13-10)9-6-11-8-12-7-9/h6-8,13H,2-5H2,1H3
InChIKeyQYFJLLLRBTVTIA-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.47
Rot. Bonds2

About 5-(2-ethylpyrrolidin-2-yl)pyrimidine

5-(2-ethylpyrrolidin-2-yl)pyrimidine (PubChem CID 66466456) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 5-(2-ethylpyrrolidin-2-yl)pyrimidine.

Molecular Properties

Compound Name5-(2-ethylpyrrolidin-2-yl)pyrimidine
PubChem CID66466456
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name5-(2-ethylpyrrolidin-2-yl)pyrimidine
SMILESCCC1(c2cncnc2)CCCN1
InChIInChI=1S/C10H15N3/c1-2-10(4-3-5-13-10)9-6-11-8-12-7-9/h6-8,13H,2-5H2,1H3
InChIKeyQYFJLLLRBTVTIA-UHFFFAOYSA-N
XLogP1.47
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-Chloro-pyrimidin-5-yl)-7-aza-bicyclo[2.2.1]heptane
CID 44264339
5-Cyclohexylpyrimidin-2-amine
CID 13163993
3-(Pyrimidin-5-yl)propan-1-amine
CID 15703007
5-(Piperidin-4-yl)pyrimidine
CID 24904194
5-Butyl-2-pyrimidinamine
CID 45071698
5-Cyclopropylpyrimidin-2-amine
CID 45080433
5-Pyrimidinepropanamine hydrochloride (1:1)
CID 122235941
5-{[rel-(3R,4S)-3-amino-4-cyclopropyl-1-pyrrolidinyl]methyl}-N-ethyl-2-pyrimidinamine dihydrochloride
CID 72860282
2-Pyrimidin-5-yl-7-azabicyclo[2.2.1]heptane
CID 49823864
5-Butylpyrimidine
CID 18952838
5-(Piperidin-4-yl)pyrimidine dihydrochloride
CID 91623829
5-(4-Fluoropiperidin-4-yl)pyrimidine dihydrochloride
CID 102551689

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethylpyrrolidin-2-yl)pyrimidine?
The IUPAC name of 5-(2-ethylpyrrolidin-2-yl)pyrimidine (CID 66466456) is 5-(2-ethylpyrrolidin-2-yl)pyrimidine.
What is the SMILES notation for 5-(2-ethylpyrrolidin-2-yl)pyrimidine?
The canonical SMILES for 5-(2-ethylpyrrolidin-2-yl)pyrimidine is CCC1(c2cncnc2)CCCN1.
What is the InChIKey of 5-(2-ethylpyrrolidin-2-yl)pyrimidine?
The InChIKey is QYFJLLLRBTVTIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-2-10(4-3-5-13-10)9-6-11-8-12-7-9/h6-8,13H,2-5H2,1H3.
What are the key properties of 5-(2-ethylpyrrolidin-2-yl)pyrimidine?
5-(2-ethylpyrrolidin-2-yl)pyrimidine has a molecular weight of 177.25 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethylpyrrolidin-2-yl)pyrimidine is sourced from PubChem (CID 66466456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).