2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide

C15H28N4O2 — CID 81451259

IUPAC2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
SMILESCCC1CN(CC(=O)N(C)CC(=O)NC2CC2)CCC1N
InChIInChI=1S/C15H28N4O2/c1-3-11-8-19(7-6-13(11)16)10-15(21)18(2)9-14(20)17-12-4-5-12/h11-13H,3-10,16H2,1-2H3,(H,17,20)
InChIKeyOVVNQZKCOJCQOO-UHFFFAOYSA-N
MW296.41 g/mol
LogP-0.22
Rot. Bonds6

About 2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide

2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide (PubChem CID 81451259) has the molecular formula C15H28N4O2 and a molecular weight of 296.41 g/mol. Its IUPAC name is 2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide.

Molecular Properties

Compound Name2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
PubChem CID81451259
Molecular FormulaC15H28N4O2
Molecular Weight296.41 g/mol
Exact Mass296.22
IUPAC Name2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
SMILESCCC1CN(CC(=O)N(C)CC(=O)NC2CC2)CCC1N
InChIInChI=1S/C15H28N4O2/c1-3-11-8-19(7-6-13(11)16)10-15(21)18(2)9-14(20)17-12-4-5-12/h11-13H,3-10,16H2,1-2H3,(H,17,20)
InChIKeyOVVNQZKCOJCQOO-UHFFFAOYSA-N
XLogP-0.22
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-amino-3-ethylpiperidin-1-yl)-N-cycloheptylacetamide
CID 81458998
2-[4-(1-aminoethyl)piperidin-1-yl]-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
CID 63595362
N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]acetamide
CID 63267509
N-[2-(cyclopropylamino)-2-oxoethyl]-N-methyl-2-piperazin-1-ylacetamide
CID 43162383
2-(4-amino-3-ethylpiperidin-1-yl)-N-cyclopropyl-N-methylacetamide
CID 81458982
N-[2-(cyclopropylamino)-2-oxoethyl]-2-[3-(2-hydroxyethyl)piperidin-1-yl]-N-methylacetamide
CID 62356308
2-(4-amino-3-ethylpiperidin-1-yl)-N-benzyl-N-methylacetamide
CID 81452559
methyl 2-(4-amino-3-ethylpiperidin-1-yl)acetate
CID 81460463
methyl N-[2-(4-amino-3-ethylpiperidin-1-yl)acetyl]carbamate
CID 81460877
2-(4-amino-2-methylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide
CID 115313084
2-(4-amino-3-ethylpiperidin-1-yl)-N-(methylcarbamoyl)acetamide
CID 81460476
N-ethyl-2-(3-ethyl-4-hydroxypiperidin-1-yl)-N-methylacetamide
CID 114510921

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide?
The IUPAC name of 2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide (CID 81451259) is 2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide.
What is the SMILES notation for 2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide?
The canonical SMILES for 2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide is CCC1CN(CC(=O)N(C)CC(=O)NC2CC2)CCC1N.
What is the InChIKey of 2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide?
The InChIKey is OVVNQZKCOJCQOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O2/c1-3-11-8-19(7-6-13(11)16)10-15(21)18(2)9-14(20)17-12-4-5-12/h11-13H,3-10,16H2,1-2H3,(H,17,20).
What are the key properties of 2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide?
2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide has a molecular weight of 296.41 g/mol, XLogP of -0.22, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-3-ethylpiperidin-1-yl)-N-[2-(cyclopropylamino)-2-oxoethyl]-N-methylacetamide is sourced from PubChem (CID 81451259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).