5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide

C16H33N3O — CID 62330562

IUPAC5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide
SMILESCCCNC(C)(CCCN1CCC(C)CC1C)C(N)=O
InChIInChI=1S/C16H33N3O/c1-5-9-18-16(4,15(17)20)8-6-10-19-11-7-13(2)12-14(19)3/h13-14,18H,5-12H2,1-4H3,(H2,17,20)
InChIKeyCOBOVIJZYAUTSI-UHFFFAOYSA-N
MW283.46 g/mol
LogP2.13
Rot. Bonds8

About 5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide

5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide (PubChem CID 62330562) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is 5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide.

Molecular Properties

Compound Name5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide
PubChem CID62330562
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC Name5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide
SMILESCCCNC(C)(CCCN1CCC(C)CC1C)C(N)=O
InChIInChI=1S/C16H33N3O/c1-5-9-18-16(4,15(17)20)8-6-10-19-11-7-13(2)12-14(19)3/h13-14,18H,5-12H2,1-4H3,(H2,17,20)
InChIKeyCOBOVIJZYAUTSI-UHFFFAOYSA-N
XLogP2.13
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)hexan-1-ol
CID 64789152
5-(2,4-dimethylpiperidin-1-yl)-2-ethyl-2-(propylamino)pentan-1-ol
CID 106808652
5-(3,4-dimethylpiperazin-1-yl)-2-methyl-2-(propylamino)pentanamide
CID 63635938
5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propan-2-ylamino)pentanoic acid
CID 62331085
methyl 2-(cyclopropylamino)-5-(2,4-dimethylpiperidin-1-yl)-2-methylpentanoate
CID 62330730
5-(2,4-dimethylpiperidin-1-yl)-N-propylpentan-1-amine
CID 62429994
4-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-methyl-2-(propylamino)butanamide
CID 102728063
5-(2,4-dimethylpiperidin-1-yl)-2-(ethylamino)-2-methylpentanenitrile
CID 62331839
2-amino-5-(2,4-dimethylpiperidin-1-yl)-2-methylpentan-1-ol
CID 64787405
1-amino-5-(2,4-dimethylpiperidin-1-yl)-2-methylpentan-2-ol
CID 64819981
ethyl 4-(2,4-dimethylpiperidin-1-yl)-2-(ethylamino)-2-methylbutanoate
CID 62329860
2-methyl-5-(2-methyl-1,4-oxazepan-4-yl)-2-(propylamino)pentanamide
CID 62974573

Frequently Asked Questions

What is the IUPAC name of 5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide?
The IUPAC name of 5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide (CID 62330562) is 5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide.
What is the SMILES notation for 5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide?
The canonical SMILES for 5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide is CCCNC(C)(CCCN1CCC(C)CC1C)C(N)=O.
What is the InChIKey of 5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide?
The InChIKey is COBOVIJZYAUTSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-5-9-18-16(4,15(17)20)8-6-10-19-11-7-13(2)12-14(19)3/h13-14,18H,5-12H2,1-4H3,(H2,17,20).
What are the key properties of 5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide?
5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide has a molecular weight of 283.46 g/mol, XLogP of 2.13, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,4-dimethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide is sourced from PubChem (CID 62330562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).