N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide

C15H31N3O — CID 63852912

IUPACN-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide
SMILESCCNC(C)C1CCN(CC(=O)NC(C)CC)CC1
InChIInChI=1S/C15H31N3O/c1-5-12(3)17-15(19)11-18-9-7-14(8-10-18)13(4)16-6-2/h12-14,16H,5-11H2,1-4H3,(H,17,19)
InChIKeyLFBAFKYIEWCFAP-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.61
Rot. Bonds7

About N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide

N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide (PubChem CID 63852912) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide
PubChem CID63852912
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC NameN-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide
SMILESCCNC(C)C1CCN(CC(=O)NC(C)CC)CC1
InChIInChI=1S/C15H31N3O/c1-5-12(3)17-15(19)11-18-9-7-14(8-10-18)13(4)16-6-2/h12-14,16H,5-11H2,1-4H3,(H,17,19)
InChIKeyLFBAFKYIEWCFAP-UHFFFAOYSA-N
XLogP1.61
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 ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 63852740
N-[(2R)-butan-2-yl]-2-[(3S)-3-hydroxypyrrolidin-1-yl]acetamide
CID 129368574
N-(1-methoxypropan-2-yl)-2-[4-[1-(methylamino)ethyl]piperidin-1-yl]acetamide
CID 63853257
2-[4-[2-(butan-2-ylamino)-2-oxoethyl]piperazin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 134045389
methyl 1-[2-(butan-2-ylamino)-2-oxoethyl]pyrrolidine-3-carboxylate
CID 112730592
N-butan-2-yl-2-(3-ethyl-4-hydroxypiperidin-1-yl)acetamide
CID 114511157
N-butan-2-yl-2-[4-[2-(1-methoxypropan-2-ylamino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 134045413
2-[4-(1-aminoethyl)piperidin-1-yl]-N-propan-2-ylacetamide
CID 63596067
N-butan-2-yl-2-[4-[(2R)-2-hydroxybutyl]piperazin-1-yl]acetamide
CID 111487266
2-(4-aminopiperidin-1-yl)-N-[(1R)-1-cyclopentylethyl]acetamide
CID 81389820
2-[4-(1-aminoethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide;hydrochloride
CID 119920920
2-[4-(1-aminoethyl)piperidin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
CID 55261186

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide?
The IUPAC name of N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide (CID 63852912) is N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide.
What is the SMILES notation for N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide?
The canonical SMILES for N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide is CCNC(C)C1CCN(CC(=O)NC(C)CC)CC1.
What is the InChIKey of N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide?
The InChIKey is LFBAFKYIEWCFAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-5-12(3)17-15(19)11-18-9-7-14(8-10-18)13(4)16-6-2/h12-14,16H,5-11H2,1-4H3,(H,17,19).
What are the key properties of N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide?
N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide has a molecular weight of 269.43 g/mol, XLogP of 1.61, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide is sourced from PubChem (CID 63852912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).