4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide

C16H33N3O2 — CID 64710220

IUPAC4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide
SMILESCCOC1CCN(C(C)CC(C)(NC(C)C)C(N)=O)CC1
InChIInChI=1S/C16H33N3O2/c1-6-21-14-7-9-19(10-8-14)13(4)11-16(5,15(17)20)18-12(2)3/h12-14,18H,6-11H2,1-5H3,(H2,17,20)
InChIKeyBEKIVPXOXHAIOA-UHFFFAOYSA-N
MW299.46 g/mol
LogP1.51
Rot. Bonds8

About 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide

4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide (PubChem CID 64710220) has the molecular formula C16H33N3O2 and a molecular weight of 299.46 g/mol. Its IUPAC name is 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide.

Molecular Properties

Compound Name4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide
PubChem CID64710220
Molecular FormulaC16H33N3O2
Molecular Weight299.46 g/mol
Exact Mass299.26
IUPAC Name4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide
SMILESCCOC1CCN(C(C)CC(C)(NC(C)C)C(N)=O)CC1
InChIInChI=1S/C16H33N3O2/c1-6-21-14-7-9-19(10-8-14)13(4)11-16(5,15(17)20)18-12(2)3/h12-14,18H,6-11H2,1-5H3,(H2,17,20)
InChIKeyBEKIVPXOXHAIOA-UHFFFAOYSA-N
XLogP1.51
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.46
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(4-methoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide
CID 64709380
2-methyl-2-(propan-2-ylamino)-4-pyrrolidin-1-ylpentanamide
CID 64725372
ethyl 2-methyl-4-(4-methylpiperidin-1-yl)-2-(propan-2-ylamino)pentanoate
CID 64725967
2-methyl-2-(propan-2-ylamino)-4-(4-propylpiperazin-1-yl)pentanamide
CID 64726163
ethyl 2-amino-4-(4-ethoxypiperidin-1-yl)-2-methylpentanoate
CID 64711971
4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(methylamino)pentan-1-ol
CID 64827462
4-(2-ethylmorpholin-4-yl)-2-methyl-2-(propan-2-ylamino)pentanamide
CID 64711142
3-(4-ethoxypiperidin-1-yl)butanehydrazide
CID 63573765
2-methyl-2-(methylamino)-4-(4-methylazepan-1-yl)pentanamide
CID 64704813
2-amino-4-(4-ethoxypiperidin-1-yl)-2-methylpentanenitrile
CID 64727482
2-(ethylamino)-2-methyl-4-(4-propylpiperidin-1-yl)pentanamide
CID 64703137
4-(2,2-dimethylmorpholin-4-yl)-2-methyl-2-(propan-2-ylamino)pentanamide
CID 64710389

Frequently Asked Questions

What is the IUPAC name of 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide?
The IUPAC name of 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide (CID 64710220) is 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide.
What is the SMILES notation for 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide?
The canonical SMILES for 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide is CCOC1CCN(C(C)CC(C)(NC(C)C)C(N)=O)CC1.
What is the InChIKey of 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide?
The InChIKey is BEKIVPXOXHAIOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O2/c1-6-21-14-7-9-19(10-8-14)13(4)11-16(5,15(17)20)18-12(2)3/h12-14,18H,6-11H2,1-5H3,(H2,17,20).
What are the key properties of 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide?
4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide has a molecular weight of 299.46 g/mol, XLogP of 1.51, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethoxypiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanamide is sourced from PubChem (CID 64710220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).