(3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone

C15H28N2O2 — CID 114498603

IUPAC(3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone
SMILESCCCNC1CCN(C(=O)C2OCCC2C)CC1C
InChIInChI=1S/C15H28N2O2/c1-4-7-16-13-5-8-17(10-12(13)3)15(18)14-11(2)6-9-19-14/h11-14,16H,4-10H2,1-3H3
InChIKeyQQTQWZAVXOAHHI-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.65
Rot. Bonds4

About (3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone

(3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone (PubChem CID 114498603) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is (3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone
PubChem CID114498603
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name(3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone
SMILESCCCNC1CCN(C(=O)C2OCCC2C)CC1C
InChIInChI=1S/C15H28N2O2/c1-4-7-16-13-5-8-17(10-12(13)3)15(18)14-11(2)6-9-19-14/h11-14,16H,4-10H2,1-3H3
InChIKeyQQTQWZAVXOAHHI-UHFFFAOYSA-N
XLogP1.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-ethyl-4-(ethylamino)piperidin-1-yl]-(3-methyloxolan-2-yl)methanone
CID 114506649
[3-methyl-4-(propylamino)piperidin-1-yl]-(2,2,3,3-tetramethylcyclopropyl)methanone
CID 114498726
7-bicyclo[4.2.0]octa-1,3,5-trienyl-[3-methyl-4-(propylamino)piperidin-1-yl]methanone
CID 114498711
(3-chloro-4-methylpiperidin-1-yl)-(3-methyloxolan-2-yl)methanone
CID 102961746
2-cyclopentyl-1-[3-methyl-4-(propylamino)piperidin-1-yl]ethanone
CID 114498667
[3-methyl-4-(propylamino)piperidin-1-yl]-phenylmethanone
CID 114498596
3-methyl-4-(propylamino)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide
CID 114498803
(3-amino-4-methylpyrrolidin-1-yl)-(3-methyloxolan-2-yl)methanone
CID 103575749
3-methyl-1-(3-methyloxolane-2-carbonyl)piperidin-4-one
CID 114499767
2-[3-methyl-4-(propylamino)piperidin-1-yl]butanamide
CID 114499454
(2-fluoro-4-methylphenyl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone
CID 114498661
1-cyclohexyl-3-methyl-N-propylpiperidin-4-amine
CID 54975332

Frequently Asked Questions

What is the IUPAC name of (3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone?
The IUPAC name of (3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone (CID 114498603) is (3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone.
What is the SMILES notation for (3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone?
The canonical SMILES for (3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone is CCCNC1CCN(C(=O)C2OCCC2C)CC1C.
What is the InChIKey of (3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone?
The InChIKey is QQTQWZAVXOAHHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-4-7-16-13-5-8-17(10-12(13)3)15(18)14-11(2)6-9-19-14/h11-14,16H,4-10H2,1-3H3.
What are the key properties of (3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone?
(3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone has a molecular weight of 268.40 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methyloxolan-2-yl)-[3-methyl-4-(propylamino)piperidin-1-yl]methanone is sourced from PubChem (CID 114498603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).