1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone

C15H28N2O — CID 107147481

IUPAC1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone
SMILESCC1CCCNC1CC(=O)N1C(C)CCCC1C
InChIInChI=1S/C15H28N2O/c1-11-6-5-9-16-14(11)10-15(18)17-12(2)7-4-8-13(17)3/h11-14,16H,4-10H2,1-3H3
InChIKeyQRFVUXRJWRAPIY-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.55
Rot. Bonds2

About 1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone

1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone (PubChem CID 107147481) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone.

Molecular Properties

Compound Name1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone
PubChem CID107147481
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone
SMILESCC1CCCNC1CC(=O)N1C(C)CCCC1C
InChIInChI=1S/C15H28N2O/c1-11-6-5-9-16-14(11)10-15(18)17-12(2)7-4-8-13(17)3/h11-14,16H,4-10H2,1-3H3
InChIKeyQRFVUXRJWRAPIY-UHFFFAOYSA-N
XLogP2.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-2-(3-methylpiperidin-2-yl)ethanone
CID 107148097
N,N-dimethyl-2-(3-methylpiperidin-2-yl)acetamide
CID 107147512
2-(3-methylpiperidin-2-yl)-1-[4-(trifluoromethyl)piperidin-1-yl]ethanone
CID 107147920
1-[4-(2-hydroxyethyl)piperazin-1-yl]-2-(3-methylpiperidin-2-yl)ethanone
CID 107147574
2,6-dimethyl-1-[(3-methylpiperidin-2-yl)methyl]piperidine
CID 107068977
N-[1-[2-(3-methylpiperidin-2-yl)acetyl]piperidin-4-yl]acetamide
CID 107148029
2-(azetidin-3-yl)-1-[(2S,6R)-2,6-dimethylpiperidin-1-yl]ethanone
CID 103810444
2-[cyclopropyl(pyrrolidin-2-ylmethyl)amino]-1-(2,6-dimethylpiperidin-1-yl)ethanone
CID 104979273
1-[(2R,6S)-2,6-dimethylpiperidin-1-yl]propan-1-one
CID 103715004
(3-methylpiperidin-2-yl)methanol
CID 19898861
N-(2-methylcyclohexyl)-2-(3-methylpiperidin-2-yl)acetamide
CID 107147462
2-[2-(3-methylpiperidin-2-yl)acetyl]-1,3,4,7,8,8a-hexahydropyrrolo[1,2-a]pyrazin-6-one
CID 107147999

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone?
The IUPAC name of 1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone (CID 107147481) is 1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone.
What is the SMILES notation for 1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone?
The canonical SMILES for 1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone is CC1CCCNC1CC(=O)N1C(C)CCCC1C.
What is the InChIKey of 1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone?
The InChIKey is QRFVUXRJWRAPIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-11-6-5-9-16-14(11)10-15(18)17-12(2)7-4-8-13(17)3/h11-14,16H,4-10H2,1-3H3.
What are the key properties of 1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone?
1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone has a molecular weight of 252.40 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dimethylpiperidin-1-yl)-2-(3-methylpiperidin-2-yl)ethanone is sourced from PubChem (CID 107147481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).