2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide

C13H27N3O — CID 61220165

IUPAC2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide
SMILESCCN1CCC(C(C)NC(C)(C)C(N)=O)CC1
InChIInChI=1S/C13H27N3O/c1-5-16-8-6-11(7-9-16)10(2)15-13(3,4)12(14)17/h10-11,15H,5-9H2,1-4H3,(H2,14,17)
InChIKeyBVXCYGBZQJJXHG-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.96
Rot. Bonds5

About 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide

2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide (PubChem CID 61220165) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide.

Molecular Properties

Compound Name2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide
PubChem CID61220165
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide
SMILESCCN1CCC(C(C)NC(C)(C)C(N)=O)CC1
InChIInChI=1S/C13H27N3O/c1-5-16-8-6-11(7-9-16)10(2)15-13(3,4)12(14)17/h10-11,15H,5-9H2,1-4H3,(H2,14,17)
InChIKeyBVXCYGBZQJJXHG-UHFFFAOYSA-N
XLogP0.96
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-(1-ethylpiperidin-4-yl)ethyl]-2-methylbut-3-yn-2-amine
CID 63999312
2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide
CID 106344149
2-[(1-ethylazepan-4-yl)amino]-2-methylpropanamide
CID 65073333
2-[1-(1-ethylpiperidin-4-yl)ethylamino]-N-methylacetamide
CID 43310362
methyl 2-[1-(1-ethylpiperidin-4-yl)ethylamino]acetate
CID 43307422
2-methyl-2-(propan-2-ylamino)-4-(4-propan-2-ylpiperidin-1-yl)butanamide
CID 103501950
N-cyclopropyl-2-[1-(1-ethylpiperidin-4-yl)ethylamino]acetamide
CID 43568260
methyl (2S)-2-[(1-ethylpiperidin-4-yl)amino]propanoate
CID 43723592
methyl 2-(1-cyclopropylethylamino)-2-methylpropanoate
CID 43726079
N-[1-[1-(2-amino-2-methylpropyl)piperidin-4-yl]ethyl]acetamide;hydrochloride
CID 120849636
5-[1-(1-ethylpiperidin-4-yl)ethylamino]-4,4-dimethylpentan-1-ol
CID 106144131
1-(1-ethylpiperidin-4-yl)ethanol
CID 588327

Frequently Asked Questions

What is the IUPAC name of 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide?
The IUPAC name of 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide (CID 61220165) is 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide.
What is the SMILES notation for 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide?
The canonical SMILES for 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide is CCN1CCC(C(C)NC(C)(C)C(N)=O)CC1.
What is the InChIKey of 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide?
The InChIKey is BVXCYGBZQJJXHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-5-16-8-6-11(7-9-16)10(2)15-13(3,4)12(14)17/h10-11,15H,5-9H2,1-4H3,(H2,14,17).
What are the key properties of 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide?
2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide has a molecular weight of 241.38 g/mol, XLogP of 0.96, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide is sourced from PubChem (CID 61220165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).