(5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone

C14H26N2O2 — CID 114824094

IUPAC(5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone
SMILESCCCNC1CCN(C(=O)C2COC(C)C2)CC1
InChIInChI=1S/C14H26N2O2/c1-3-6-15-13-4-7-16(8-5-13)14(17)12-9-11(2)18-10-12/h11-13,15H,3-10H2,1-2H3
InChIKeyOYSTXMFFDLNKHQ-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.40
Rot. Bonds4

About (5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone

(5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone (PubChem CID 114824094) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is (5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone
PubChem CID114824094
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name(5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone
SMILESCCCNC1CCN(C(=O)C2COC(C)C2)CC1
InChIInChI=1S/C14H26N2O2/c1-3-6-15-13-4-7-16(8-5-13)14(17)12-9-11(2)18-10-12/h11-13,15H,3-10H2,1-2H3
InChIKeyOYSTXMFFDLNKHQ-UHFFFAOYSA-N
XLogP1.40
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(5-methyloxolan-3-yl)-piperidin-1-ylmethanone
CID 114826120
(5-methyloxolan-3-yl)-morpholin-4-ylmethanone
CID 114826121
(3-methylazetidin-1-yl)-(5-methyloxolan-3-yl)methanone
CID 130634223
[(3S)-3-hydroxypyrrolidin-1-yl]-(5-methyloxolan-3-yl)methanone
CID 104979230
4-(propylamino)piperidine-1-carbothioic S-acid
CID 143221289
2-[4-(5-methyloxolane-3-carbonyl)piperazin-1-yl]acetic acid
CID 114824351
(4-hydroxy-3-methylpiperidin-1-yl)-(5-methyloxolan-3-yl)methanone
CID 114826278
2-bicyclo[2.2.1]heptanyl-[4-(propylamino)piperidin-1-yl]methanone
CID 61366100
[4-(1-aminopropan-2-yl)piperazin-1-yl]-(5-methyloxolan-3-yl)methanone
CID 114824162
[4-[2-(tert-butylamino)ethylamino]piperidin-1-yl]-cyclopropylmethanone
CID 107445266
2-[4-(5-methyloxolane-3-carbonyl)piperazin-1-yl]butanethioamide
CID 114825622
[4-(5-aminopentyl)piperazin-1-yl]-(5-methyloxolan-3-yl)methanone
CID 114824137

Frequently Asked Questions

What is the IUPAC name of (5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone?
The IUPAC name of (5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone (CID 114824094) is (5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone.
What is the SMILES notation for (5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone?
The canonical SMILES for (5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone is CCCNC1CCN(C(=O)C2COC(C)C2)CC1.
What is the InChIKey of (5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone?
The InChIKey is OYSTXMFFDLNKHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-3-6-15-13-4-7-16(8-5-13)14(17)12-9-11(2)18-10-12/h11-13,15H,3-10H2,1-2H3.
What are the key properties of (5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone?
(5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone has a molecular weight of 254.37 g/mol, XLogP of 1.40, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methyloxolan-3-yl)-[4-(propylamino)piperidin-1-yl]methanone is sourced from PubChem (CID 114824094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).