(3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone

C16H30N2O — CID 83052876

IUPAC(3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone
SMILESCCCC1CCCCN1C(=O)C1(CC)CCCNC1
InChIInChI=1S/C16H30N2O/c1-3-8-14-9-5-6-12-18(14)15(19)16(4-2)10-7-11-17-13-16/h14,17H,3-13H2,1-2H3
InChIKeyAYGODKHZDSIWAF-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.95
Rot. Bonds4

About (3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone

(3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone (PubChem CID 83052876) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is (3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone
PubChem CID83052876
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name(3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone
SMILESCCCC1CCCCN1C(=O)C1(CC)CCCNC1
InChIInChI=1S/C16H30N2O/c1-3-8-14-9-5-6-12-18(14)15(19)16(4-2)10-7-11-17-13-16/h14,17H,3-13H2,1-2H3
InChIKeyAYGODKHZDSIWAF-UHFFFAOYSA-N
XLogP2.95
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-ethylpyrrolidin-3-yl)-[2-(3-hydroxypropyl)pyrrolidin-1-yl]methanone
CID 63141995
(3-ethylpiperidin-3-yl)-(4-propylpiperidin-1-yl)methanone
CID 63135150
3-[1-(3-propylpyrrolidine-3-carbonyl)piperidin-2-yl]propanoic acid
CID 63142470
2-[1-(3-ethylpyrrolidine-3-carbonyl)pyrrolidin-2-yl]acetic acid
CID 55164770
3-[1-(4-ethylpiperidine-4-carbonyl)piperidin-2-yl]propanoic acid
CID 63129046
(2S)-1-(3-ethylpyrrolidine-3-carbonyl)piperidine-2-carboxylic acid
CID 66264088
1-(3-ethylpiperidine-3-carbonyl)-2-methylpiperidine-4-carboxylic acid
CID 106742943
azocan-1-yl-(3-ethylpiperidin-3-yl)methanone
CID 55179345
[2-(aminomethyl)azepan-1-yl]-(1-ethylcyclopentyl)methanone
CID 116639879
1-(3-propylpiperidine-3-carbonyl)piperidine-2-carboxamide
CID 63131177
1-(3-ethylpiperidine-3-carbonyl)-3-methylpyrrolidine-2-carboxylic acid
CID 102780244
(3-ethylpiperidin-3-yl)-[2-(hydroxymethyl)-3-methylpyrrolidin-1-yl]methanone
CID 102780497

Frequently Asked Questions

What is the IUPAC name of (3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone?
The IUPAC name of (3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone (CID 83052876) is (3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone.
What is the SMILES notation for (3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone?
The canonical SMILES for (3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone is CCCC1CCCCN1C(=O)C1(CC)CCCNC1.
What is the InChIKey of (3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone?
The InChIKey is AYGODKHZDSIWAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-3-8-14-9-5-6-12-18(14)15(19)16(4-2)10-7-11-17-13-16/h14,17H,3-13H2,1-2H3.
What are the key properties of (3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone?
(3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone has a molecular weight of 266.43 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethylpiperidin-3-yl)-(2-propylpiperidin-1-yl)methanone is sourced from PubChem (CID 83052876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).