4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide

C16H33N3O — CID 64727643

IUPAC4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide
SMILESCCCNC(C)(CC(C)N1CCCCC1CC)C(N)=O
InChIInChI=1S/C16H33N3O/c1-5-10-18-16(4,15(17)20)12-13(3)19-11-8-7-9-14(19)6-2/h13-14,18H,5-12H2,1-4H3,(H2,17,20)
InChIKeyRTEXMTWGPGLDNS-UHFFFAOYSA-N
MW283.46 g/mol
LogP2.27
Rot. Bonds8

About 4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide

4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide (PubChem CID 64727643) has the molecular formula C16H33N3O and a molecular weight of 283.46 g/mol. Its IUPAC name is 4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide.

Molecular Properties

Compound Name4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide
PubChem CID64727643
Molecular FormulaC16H33N3O
Molecular Weight283.46 g/mol
Exact Mass283.26
IUPAC Name4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide
SMILESCCCNC(C)(CC(C)N1CCCCC1CC)C(N)=O
InChIInChI=1S/C16H33N3O/c1-5-10-18-16(4,15(17)20)12-13(3)19-11-8-7-9-14(19)6-2/h13-14,18H,5-12H2,1-4H3,(H2,17,20)
InChIKeyRTEXMTWGPGLDNS-UHFFFAOYSA-N
XLogP2.27
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 ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-ethylazepan-1-yl)-2-methyl-2-(propylamino)pentanamide
CID 104691662
4-(2-ethylpyrrolidin-1-yl)-2-methyl-2-(propylamino)pentanoic acid
CID 64726316
2-(cyclopropylamino)-4-(2-ethylazepan-1-yl)-2-methylpentanoic acid
CID 104691548
2-methyl-4-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-2-(propylamino)pentanamide
CID 102886110
3-(2-ethylpiperidin-1-yl)butanehydrazide
CID 63573262
1-amino-4-(2-ethylpiperidin-1-yl)-2-methylpentan-2-ol
CID 64820664
N-tert-butyl-3-(2-ethylazepan-1-yl)butan-1-amine
CID 104692382
4-(2,3,3a,4,5,6,7,7a-octahydroindol-1-yl)-2-methyl-2-(propylamino)pentanoic acid
CID 82752804
2-(2-ethylpiperidin-1-yl)propanoic acid
CID 20985444
4-[(4aR,8aR)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-2-methyl-2-(methylamino)pentanamide
CID 102727993
ethyl 3-(2-ethylazepan-1-yl)-2-methyl-2-(propylamino)propanoate
CID 104691578
4-(3-ethylcyclohexyl)oxy-2-methyl-2-(propylamino)pentanamide
CID 64719823

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide?
The IUPAC name of 4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide (CID 64727643) is 4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide.
What is the SMILES notation for 4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide?
The canonical SMILES for 4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide is CCCNC(C)(CC(C)N1CCCCC1CC)C(N)=O.
What is the InChIKey of 4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide?
The InChIKey is RTEXMTWGPGLDNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O/c1-5-10-18-16(4,15(17)20)12-13(3)19-11-8-7-9-14(19)6-2/h13-14,18H,5-12H2,1-4H3,(H2,17,20).
What are the key properties of 4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide?
4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide has a molecular weight of 283.46 g/mol, XLogP of 2.27, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylpiperidin-1-yl)-2-methyl-2-(propylamino)pentanamide is sourced from PubChem (CID 64727643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).