2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide

C17H27N3O2 — CID 146423523

IUPAC2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide
SMILESCc1ncccc1OCC(C)(C)C(=O)NC1CCN(C)CC1
InChIInChI=1S/C17H27N3O2/c1-13-15(6-5-9-18-13)22-12-17(2,3)16(21)19-14-7-10-20(4)11-8-14/h5-6,9,14H,7-8,10-12H2,1-4H3,(H,19,21)
InChIKeyUUVVHTYUTIEOMC-UHFFFAOYSA-N
MW305.42 g/mol
LogP2.01
Rot. Bonds5

About 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide

2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide (PubChem CID 146423523) has the molecular formula C17H27N3O2 and a molecular weight of 305.42 g/mol. Its IUPAC name is 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide
PubChem CID146423523
Molecular FormulaC17H27N3O2
Molecular Weight305.42 g/mol
Exact Mass305.21
IUPAC Name2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide
SMILESCc1ncccc1OCC(C)(C)C(=O)NC1CCN(C)CC1
InChIInChI=1S/C17H27N3O2/c1-13-15(6-5-9-18-13)22-12-17(2,3)16(21)19-14-7-10-20(4)11-8-14/h5-6,9,14H,7-8,10-12H2,1-4H3,(H,19,21)
InChIKeyUUVVHTYUTIEOMC-UHFFFAOYSA-N
XLogP2.01
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Pozanicline
CID 178052
5-[[(2S)-azetidin-2-yl]methoxy]-2-methylpyridine
CID 18391693
5-[[(2R)-azetidin-2-yl]methoxy]-2-methylpyridine
CID 21345253
N-[[5-[[(2S)-azetidin-2-yl]methoxy]-3-pyridinyl]methyl]acetamide
CID 21971458
(R)-2-Methyl-3-(2-pyrrolidinylmethoxy)pyridine
CID 127922
3-(3-Piperidinyloxy)pyridine
CID 9815392
N-methyl-1-[(6-methyl-3-pyridinyl)oxymethyl]cyclopropan-1-amine;hydrochloride
CID 9899400
(S)-3-(Azetidin-2-ylmethoxy)-2-methylpyridine
CID 18391690
5-[[(2S)-azetidin-2-yl]methoxy]-2-ethenylpyridine
CID 22961867
(2R)-N-(4-methoxyphenyl)-2-(pyridin-3-yloxymethyl)piperazine-1-carboxamide
CID 24877085
N-(4-methoxyphenyl)-2-(pyridin-3-yloxymethyl)piperazine-1-carboxamide
CID 24878344
5-[[(2S)-azetidin-2-yl]methoxy]-2-ethylpyridine
CID 44327374

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide?
The IUPAC name of 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide (CID 146423523) is 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide?
The canonical SMILES for 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide is Cc1ncccc1OCC(C)(C)C(=O)NC1CCN(C)CC1.
What is the InChIKey of 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide?
The InChIKey is UUVVHTYUTIEOMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O2/c1-13-15(6-5-9-18-13)22-12-17(2,3)16(21)19-14-7-10-20(4)11-8-14/h5-6,9,14H,7-8,10-12H2,1-4H3,(H,19,21).
What are the key properties of 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide?
2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide has a molecular weight of 305.42 g/mol, XLogP of 2.01, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(1-methylpiperidin-4-yl)-3-[(2-methyl-3-pyridinyl)oxy]propanamide is sourced from PubChem (CID 146423523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).