2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide

C13H26N4O2 — CID 81460901

IUPAC2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide
SMILESCCNC(=O)NC(=O)C(C)N1CCC(N)C(CC)C1
InChIInChI=1S/C13H26N4O2/c1-4-10-8-17(7-6-11(10)14)9(3)12(18)16-13(19)15-5-2/h9-11H,4-8,14H2,1-3H3,(H2,15,16,18,19)
InChIKeyMVHUWTAPXFQBBO-UHFFFAOYSA-N
MW270.38 g/mol
LogP0.28
Rot. Bonds4

About 2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide

2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide (PubChem CID 81460901) has the molecular formula C13H26N4O2 and a molecular weight of 270.38 g/mol. Its IUPAC name is 2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide.

Molecular Properties

Compound Name2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide
PubChem CID81460901
Molecular FormulaC13H26N4O2
Molecular Weight270.38 g/mol
Exact Mass270.21
IUPAC Name2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide
SMILESCCNC(=O)NC(=O)C(C)N1CCC(N)C(CC)C1
InChIInChI=1S/C13H26N4O2/c1-4-10-8-17(7-6-11(10)14)9(3)12(18)16-13(19)15-5-2/h9-11H,4-8,14H2,1-3H3,(H2,15,16,18,19)
InChIKeyMVHUWTAPXFQBBO-UHFFFAOYSA-N
XLogP0.28
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 50.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-aminopyrrolidin-1-yl)-N-(ethylcarbamoyl)propanamide;hydrochloride
CID 119917700
2-(4-amino-3-ethylpiperidin-1-yl)-N-(2-methylpropyl)propanamide
CID 81460274
N-(ethylcarbamoyl)-2-(4-methylpiperidin-1-yl)propanamide
CID 46614180
(2R)-2-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]-N-(ethylcarbamoyl)propanamide
CID 11931790
methyl 1-[1-(ethylcarbamoylamino)-1-oxopropan-2-yl]piperidine-4-carboxylate
CID 60638894
N-(ethylcarbamoyl)-2-(3-hydroxyazetidin-1-yl)propanamide
CID 63282323
N-(ethylcarbamoyl)-2-[3-(hydroxymethyl)piperidin-1-yl]propanamide
CID 60638694
2-[3-(2-aminoethyl)piperidin-1-yl]-N-(ethylcarbamoyl)propanamide
CID 63763714
2-(4-amino-3-ethylpiperidin-1-yl)-1-pyrrolidin-1-ylpropan-1-one
CID 81459438
2-[2-(aminomethyl)morpholin-4-yl]-N-(ethylcarbamoyl)propanamide
CID 61338002
2-(4-amino-3-methylpiperidin-1-yl)-N-(methylcarbamoyl)propanamide
CID 79867465
(2R)-2-[4-(1,3-dioxolan-2-yl)piperidin-1-yl]-N-(ethylcarbamoyl)propanamide
CID 95269319

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide?
The IUPAC name of 2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide (CID 81460901) is 2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide.
What is the SMILES notation for 2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide?
The canonical SMILES for 2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide is CCNC(=O)NC(=O)C(C)N1CCC(N)C(CC)C1.
What is the InChIKey of 2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide?
The InChIKey is MVHUWTAPXFQBBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N4O2/c1-4-10-8-17(7-6-11(10)14)9(3)12(18)16-13(19)15-5-2/h9-11H,4-8,14H2,1-3H3,(H2,15,16,18,19).
What are the key properties of 2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide?
2-(4-amino-3-ethylpiperidin-1-yl)-N-(ethylcarbamoyl)propanamide has a molecular weight of 270.38 g/mol, XLogP of 0.28, 4 rotatable bonds, 3 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-(ethylcarbamoyl)propanamide is sourced from PubChem (CID 81460901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).