N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide

C15H31N3O — CID 83994814

IUPACN-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide
SMILESCCC1CC(NCC(C)C)CN(CCNC(C)=O)C1
InChIInChI=1S/C15H31N3O/c1-5-14-8-15(17-9-12(2)3)11-18(10-14)7-6-16-13(4)19/h12,14-15,17H,5-11H2,1-4H3,(H,16,19)
InChIKeyKXZXGXHYESQYCF-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.47
Rot. Bonds7

About N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide

N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide (PubChem CID 83994814) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide
PubChem CID83994814
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC NameN-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide
SMILESCCC1CC(NCC(C)C)CN(CCNC(C)=O)C1
InChIInChI=1S/C15H31N3O/c1-5-14-8-15(17-9-12(2)3)11-18(10-14)7-6-16-13(4)19/h12,14-15,17H,5-11H2,1-4H3,(H,16,19)
InChIKeyKXZXGXHYESQYCF-UHFFFAOYSA-N
XLogP1.47
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[3-(cyclopentylmethylamino)-5-ethylpiperidin-1-yl]ethyl]acetamide
CID 83998272
methyl N-[1-(2-acetamidoethyl)-5-ethylpiperidin-3-yl]carbamate
CID 112543606
2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethanol
CID 83994767
1-(2-acetamidoethyl)-5-(3-methylbutylamino)piperidine-3-carboxylic acid
CID 83996201
N-[2-[3-propyl-5-(2,2,2-trifluoroethylamino)piperidin-1-yl]ethyl]acetamide
CID 83992738
1-(2-acetamidoethyl)-5-(2,2-difluoroethylamino)piperidine-3-carboxylic acid
CID 83993434
methyl N-[1-(2-acetamidoethyl)-5-propylpiperidin-3-yl]carbamate
CID 112543607
N-[1-(2-acetamidoethyl)-5-propylpiperidin-3-yl]-2,2-dimethylpropanamide
CID 112542522
N-[2-[3-acetamido-5-(1-hydroxyethyl)piperidin-1-yl]ethyl]acetamide
CID 112542079
N-[2-[3-methyl-5-(methylamino)piperidin-1-yl]ethyl]acetamide
CID 83990134
N-[2-(3,4-dimethylpyrrolidin-1-yl)ethyl]acetamide
CID 126999485
N-[2-(3,4-dihydroxypyrrolidin-1-yl)ethyl]acetamide
CID 106672120

Frequently Asked Questions

What is the IUPAC name of N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide?
The IUPAC name of N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide (CID 83994814) is N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide.
What is the SMILES notation for N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide?
The canonical SMILES for N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide is CCC1CC(NCC(C)C)CN(CCNC(C)=O)C1.
What is the InChIKey of N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide?
The InChIKey is KXZXGXHYESQYCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-5-14-8-15(17-9-12(2)3)11-18(10-14)7-6-16-13(4)19/h12,14-15,17H,5-11H2,1-4H3,(H,16,19).
What are the key properties of N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide?
N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide has a molecular weight of 269.43 g/mol, XLogP of 1.47, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[3-ethyl-5-(2-methylpropylamino)piperidin-1-yl]ethyl]acetamide is sourced from PubChem (CID 83994814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).