[4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone

C16H30N2O2 — CID 83052187

IUPAC[4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone
SMILESCCCNC1COCC1C(=O)N1CCCCC1CCC
InChIInChI=1S/C16H30N2O2/c1-3-7-13-8-5-6-10-18(13)16(19)14-11-20-12-15(14)17-9-4-2/h13-15,17H,3-12H2,1-2H3
InChIKeyHSCKUFVHWSPWTA-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.18
Rot. Bonds6

About [4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone

[4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone (PubChem CID 83052187) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is [4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name[4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone
PubChem CID83052187
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name[4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone
SMILESCCCNC1COCC1C(=O)N1CCCCC1CCC
InChIInChI=1S/C16H30N2O2/c1-3-7-13-8-5-6-10-18(13)16(19)14-11-20-12-15(14)17-9-4-2/h13-15,17H,3-12H2,1-2H3
InChIKeyHSCKUFVHWSPWTA-UHFFFAOYSA-N
XLogP2.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-ethylpyrrolidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone
CID 66255960
1-[4-(propylamino)oxolane-3-carbonyl]pyrrolidine-2-carboxylic acid
CID 66256153
2-(2-propylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 83053442
cyclopropyl-[4-(propylamino)oxolan-3-yl]methanone
CID 116587886
[4-(propylamino)oxolan-3-yl]-(2,3,5-trimethylpiperidin-1-yl)methanone
CID 114593120
(4-methyl-1,4-diazepan-1-yl)-[4-(propylamino)oxolan-3-yl]methanone
CID 66256881
[3-(2-hydroxyethyl)pyrrolidin-1-yl]-[4-(propylamino)oxolan-3-yl]methanone
CID 114797463
[3-(dimethylamino)pyrrolidin-1-yl]-[4-(propylamino)oxolan-3-yl]methanone
CID 66256744
[4-(methylamino)oxolan-3-yl]-(2-methylazepan-1-yl)methanone
CID 66266661
(4,4-diethylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone
CID 66256555
[4-(propylamino)oxolan-3-yl]-(4-prop-2-ynylpiperazin-1-yl)methanone
CID 66254425
(4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone
CID 66256554

Frequently Asked Questions

What is the IUPAC name of [4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone?
The IUPAC name of [4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone (CID 83052187) is [4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone.
What is the SMILES notation for [4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone?
The canonical SMILES for [4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone is CCCNC1COCC1C(=O)N1CCCCC1CCC.
What is the InChIKey of [4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone?
The InChIKey is HSCKUFVHWSPWTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-3-7-13-8-5-6-10-18(13)16(19)14-11-20-12-15(14)17-9-4-2/h13-15,17H,3-12H2,1-2H3.
What are the key properties of [4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone?
[4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone has a molecular weight of 282.43 g/mol, XLogP of 2.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(propylamino)oxolan-3-yl]-(2-propylpiperidin-1-yl)methanone is sourced from PubChem (CID 83052187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).