2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide

C14H29N3O — CID 106344149

IUPAC2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide
SMILESCCN1CCC(C(C)NC(C(N)=O)C(C)C)CC1
InChIInChI=1S/C14H29N3O/c1-5-17-8-6-12(7-9-17)11(4)16-13(10(2)3)14(15)18/h10-13,16H,5-9H2,1-4H3,(H2,15,18)
InChIKeyRJWNGGAKHBLMJW-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.21
Rot. Bonds6

About 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide

2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide (PubChem CID 106344149) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide.

Molecular Properties

Compound Name2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide
PubChem CID106344149
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide
SMILESCCN1CCC(C(C)NC(C(N)=O)C(C)C)CC1
InChIInChI=1S/C14H29N3O/c1-5-17-8-6-12(7-9-17)11(4)16-13(10(2)3)14(15)18/h10-13,16H,5-9H2,1-4H3,(H2,15,18)
InChIKeyRJWNGGAKHBLMJW-UHFFFAOYSA-N
XLogP1.21
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(1-cyclohexylethylamino)-3-methylbutanamide
CID 103729646
2-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylpropanamide
CID 61220165
2-[1-(1-ethylpiperidin-4-yl)ethylamino]-N-methylacetamide
CID 43310362
methyl 2-[1-(1-ethylpiperidin-4-yl)ethylamino]acetate
CID 43307422
N-cyclopropyl-2-[1-(1-ethylpiperidin-4-yl)ethylamino]acetamide
CID 43568260
3-[1-(1-ethylpiperidin-4-yl)ethylamino]-2-methylsulfanylbutan-1-ol
CID 106158702
ethyl 2-[1-(1-propylpiperidin-4-yl)ethylamino]propanoate
CID 61498192
2-[1-(1-ethylpiperidin-4-yl)ethylamino]-4-methoxybutan-1-ol
CID 114210339
methyl (2S)-2-[(1-ethylpiperidin-4-yl)amino]propanoate
CID 43723592
N-[1-(1-ethylpiperidin-4-yl)ethyl]octan-4-amine
CID 106023059
1-ethyl-4-(2-methylpentan-3-yl)piperidine
CID 170952036
benzene;1-ethylpiperidine-4-carboxamide
CID 91582947

Frequently Asked Questions

What is the IUPAC name of 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide?
The IUPAC name of 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide (CID 106344149) is 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide.
What is the SMILES notation for 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide?
The canonical SMILES for 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide is CCN1CCC(C(C)NC(C(N)=O)C(C)C)CC1.
What is the InChIKey of 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide?
The InChIKey is RJWNGGAKHBLMJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-5-17-8-6-12(7-9-17)11(4)16-13(10(2)3)14(15)18/h10-13,16H,5-9H2,1-4H3,(H2,15,18).
What are the key properties of 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide?
2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide has a molecular weight of 255.41 g/mol, XLogP of 1.21, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(1-ethylpiperidin-4-yl)ethylamino]-3-methylbutanamide is sourced from PubChem (CID 106344149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).