4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine

C14H22N4O — CID 172905311

IUPAC4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine
SMILESCCc1cc(N2CCC(N3CCOCC3)C2)ncn1
InChIInChI=1S/C14H22N4O/c1-2-12-9-14(16-11-15-12)18-4-3-13(10-18)17-5-7-19-8-6-17/h9,11,13H,2-8,10H2,1H3
InChIKeyPPQDHCMWSKCSDY-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.95
Rot. Bonds3

About 4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine

4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine (PubChem CID 172905311) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine.

Molecular Properties

Compound Name4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine
PubChem CID172905311
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine
SMILESCCc1cc(N2CCC(N3CCOCC3)C2)ncn1
InChIInChI=1S/C14H22N4O/c1-2-12-9-14(16-11-15-12)18-4-3-13(10-18)17-5-7-19-8-6-17/h9,11,13H,2-8,10H2,1H3
InChIKeyPPQDHCMWSKCSDY-UHFFFAOYSA-N
XLogP0.95
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-[1-[6-(3-morpholin-4-ylpyrrolidin-1-yl)pyrimidin-4-yl]pyrrolidin-3-yl]morpholine
CID 133484407
4-[1-(6-ethyl-2-methylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine
CID 133461297
4-[(1R)-1-[1-(6-ethylpyrimidin-4-yl)piperidin-4-yl]ethyl]morpholine
CID 97199716
4-(4-bromo-3-methylpiperidin-1-yl)-6-ethylpyrimidine
CID 114682855
[2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanol
CID 63171090
[5-chloro-2-(3-morpholin-4-ylpyrrolidin-1-yl)-4-pyridinyl]methanamine
CID 114926413
4-[1-(6-chloropyrimidin-4-yl)piperidin-4-yl]morpholine
CID 22309538
1-(6-ethylpyrimidin-4-yl)-N-methylpiperidin-3-amine
CID 62545846
4-[4-(chloromethyl)piperidin-1-yl]-6-ethylpyrimidine
CID 63390468
6-(3-morpholin-4-ylpyrrolidin-1-yl)pyrazin-2-amine
CID 79026019
1-(6-ethylpyrimidin-4-yl)azetidin-3-amine
CID 63759800
4-[1-[2-tert-butyl-6-(methoxymethyl)pyrimidin-4-yl]pyrrolidin-3-yl]morpholine
CID 133402499

Frequently Asked Questions

What is the IUPAC name of 4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine?
The IUPAC name of 4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine (CID 172905311) is 4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine.
What is the SMILES notation for 4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine?
The canonical SMILES for 4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine is CCc1cc(N2CCC(N3CCOCC3)C2)ncn1.
What is the InChIKey of 4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine?
The InChIKey is PPQDHCMWSKCSDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-2-12-9-14(16-11-15-12)18-4-3-13(10-18)17-5-7-19-8-6-17/h9,11,13H,2-8,10H2,1H3.
What are the key properties of 4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine?
4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine has a molecular weight of 262.36 g/mol, XLogP of 0.95, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(6-ethylpyrimidin-4-yl)pyrrolidin-3-yl]morpholine is sourced from PubChem (CID 172905311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).