2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide

C13H25N3O — CID 79993534

IUPAC2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide
SMILESCCN(C(=O)CN1CC(C)CC(N)C1)C1CC1
InChIInChI=1S/C13H25N3O/c1-3-16(12-4-5-12)13(17)9-15-7-10(2)6-11(14)8-15/h10-12H,3-9,14H2,1-2H3
InChIKeyQHRPJFMPEATDQW-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.67
Rot. Bonds4

About 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide

2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide (PubChem CID 79993534) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide.

Molecular Properties

Compound Name2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide
PubChem CID79993534
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide
SMILESCCN(C(=O)CN1CC(C)CC(N)C1)C1CC1
InChIInChI=1S/C13H25N3O/c1-3-16(12-4-5-12)13(17)9-15-7-10(2)6-11(14)8-15/h10-12H,3-9,14H2,1-2H3
InChIKeyQHRPJFMPEATDQW-UHFFFAOYSA-N
XLogP0.67
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-amino-5-methylpiperidin-1-yl)-N-cyclohexyl-N-ethylacetamide
CID 79992651
2-(3-aminopyrrolidin-1-yl)-N-cyclohexyl-N-ethylacetamide;hydrochloride
CID 119917689
2-(3-amino-5-methylpiperidin-1-yl)-N-(cyclopenten-1-yl)-N-ethylacetamide
CID 79994189
2-(3-amino-5-methylpiperidin-1-yl)-N-(cyclohexen-1-yl)-N-ethylacetamide
CID 79994225
2-[4-(2-amino-2-sulfanylideneethyl)piperazin-1-yl]-N-cyclopropyl-N-ethylacetamide
CID 63336169
2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopropyl-N-ethylacetamide
CID 61488497
2-(3-aminoazetidin-1-yl)-N-cyclopropyl-N-methylacetamide
CID 63760735
2-(5-amino-4-methyl-2-oxopiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide
CID 79355664
1-(2,3-dichloroprop-2-enyl)-5-methylpiperidin-3-amine
CID 79993012
N-cyclopropyl-N-ethyl-2-(3-hydroxy-3-methylpyrrolidin-1-yl)acetamide
CID 103728655
2-(3-amino-5-methylpiperidin-1-yl)-N-(2-methylpropyl)acetamide
CID 79993447
N-(4-aminocyclohexyl)-N-ethyl-2-(1,2,4-triazol-1-yl)acetamide
CID 79115940

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide?
The IUPAC name of 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide (CID 79993534) is 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide.
What is the SMILES notation for 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide?
The canonical SMILES for 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide is CCN(C(=O)CN1CC(C)CC(N)C1)C1CC1.
What is the InChIKey of 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide?
The InChIKey is QHRPJFMPEATDQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-3-16(12-4-5-12)13(17)9-15-7-10(2)6-11(14)8-15/h10-12H,3-9,14H2,1-2H3.
What are the key properties of 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide?
2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide has a molecular weight of 239.36 g/mol, XLogP of 0.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-5-methylpiperidin-1-yl)-N-cyclopropyl-N-ethylacetamide is sourced from PubChem (CID 79993534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).