2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid

C14H26N2O3 — CID 66434708

IUPAC2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid
SMILESCCCN1CCC(N2CCOC(CC(=O)O)C2)CC1
InChIInChI=1S/C14H26N2O3/c1-2-5-15-6-3-12(4-7-15)16-8-9-19-13(11-16)10-14(17)18/h12-13H,2-11H2,1H3,(H,17,18)
InChIKeyPPDQROBDMXMWBZ-UHFFFAOYSA-N
MW270.37 g/mol
LogP1.04
Rot. Bonds5

About 2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid

2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid (PubChem CID 66434708) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is 2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid.

Molecular Properties

Compound Name2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid
PubChem CID66434708
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC Name2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid
SMILESCCCN1CCC(N2CCOC(CC(=O)O)C2)CC1
InChIInChI=1S/C14H26N2O3/c1-2-5-15-6-3-12(4-7-15)16-8-9-19-13(11-16)10-14(17)18/h12-13H,2-11H2,1H3,(H,17,18)
InChIKeyPPDQROBDMXMWBZ-UHFFFAOYSA-N
XLogP1.04
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-cyclohexylmorpholin-2-yl)acetic acid
CID 66433671
2-[1-(1-propylpiperidin-4-yl)azetidin-3-yl]acetic acid
CID 65069382
2-[4-(oxan-3-yl)morpholin-2-yl]acetic acid
CID 66432953
2-[4-(2,4-dimethylcyclohexyl)morpholin-2-yl]acetic acid
CID 66435669
methyl 2-(4-cyclopentylmorpholin-2-yl)acetate
CID 115537752
2-(1-propylpiperidin-4-yl)acetic acid;hydrochloride
CID 75530728
(3S)-1-(1-propylpiperidin-4-yl)piperidine-3-carboxamide
CID 30982597
2-[4-(2,2-dimethylcyclopentyl)morpholin-2-yl]acetic acid
CID 79862286
2-[4-(4-methylpentyl)morpholin-2-yl]acetic acid
CID 83158040
2-methyl-2-[1-(1-propylpiperidin-4-yl)piperidin-3-yl]propanoic acid
CID 83198549
2-[4-[(1-propylpyrazol-4-yl)methyl]morpholin-2-yl]acetic acid
CID 103573426
[1-(1-propylpiperidin-4-yl)pyrrolidin-3-yl]methanol
CID 64866043

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid?
The IUPAC name of 2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid (CID 66434708) is 2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid.
What is the SMILES notation for 2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid?
The canonical SMILES for 2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid is CCCN1CCC(N2CCOC(CC(=O)O)C2)CC1.
What is the InChIKey of 2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid?
The InChIKey is PPDQROBDMXMWBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-2-5-15-6-3-12(4-7-15)16-8-9-19-13(11-16)10-14(17)18/h12-13H,2-11H2,1H3,(H,17,18).
What are the key properties of 2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid?
2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid has a molecular weight of 270.37 g/mol, XLogP of 1.04, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid is sourced from PubChem (CID 66434708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).