2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide

C15H31N3O — CID 63852740

IUPAC2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide
SMILESCCNC(C)C1CCN(CC(=O)N(C)C(C)C)CC1
InChIInChI=1S/C15H31N3O/c1-6-16-13(4)14-7-9-18(10-8-14)11-15(19)17(5)12(2)3/h12-14,16H,6-11H2,1-5H3
InChIKeyYMPWCZSLCNUZGE-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.56
Rot. Bonds6

About 2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide

2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide (PubChem CID 63852740) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide
PubChem CID63852740
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide
SMILESCCNC(C)C1CCN(CC(=O)N(C)C(C)C)CC1
InChIInChI=1S/C15H31N3O/c1-6-16-13(4)14-7-9-18(10-8-14)11-15(19)17(5)12(2)3/h12-14,16H,6-11H2,1-5H3
InChIKeyYMPWCZSLCNUZGE-UHFFFAOYSA-N
XLogP1.56
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-propan-2-yl-2-[4-[(propan-2-ylamino)methyl]piperidin-1-yl]acetamide
CID 63848072
N-butan-2-yl-2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]acetamide
CID 63852912
2-[2-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 63853649
methyl 1-[2-[methyl(propan-2-yl)amino]-2-oxoethyl]piperidine-4-carboxylate
CID 60669971
2-(4-cyanopiperidin-1-yl)-N-methyl-N-propan-2-ylacetamide
CID 48966293
3-[1-[2-[methyl(propan-2-yl)amino]-2-oxoethyl]piperidin-4-yl]propanoic acid
CID 62215678
2-[4-[(2-methoxyethylamino)methyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 63848275
1-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-2-methylpropan-2-ol
CID 63853262
(1S)-1-cyclopropyl-N-ethylethanamine
CID 42056539
2-[(3R)-3-(4-ethylpiperazin-1-yl)pyrrolidin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 97028839
2-(3-hydroxyazetidin-1-yl)-N-methyl-N-propan-2-ylacetamide
CID 63282746
4-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-2-methylbutan-2-ol
CID 79359785

Frequently Asked Questions

What is the IUPAC name of 2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide?
The IUPAC name of 2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide (CID 63852740) is 2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide?
The canonical SMILES for 2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide is CCNC(C)C1CCN(CC(=O)N(C)C(C)C)CC1.
What is the InChIKey of 2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide?
The InChIKey is YMPWCZSLCNUZGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-6-16-13(4)14-7-9-18(10-8-14)11-15(19)17(5)12(2)3/h12-14,16H,6-11H2,1-5H3.
What are the key properties of 2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide?
2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide has a molecular weight of 269.43 g/mol, XLogP of 1.56, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[1-(ethylamino)ethyl]piperidin-1-yl]-N-methyl-N-propan-2-ylacetamide is sourced from PubChem (CID 63852740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).