2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide

C12H25N3O — CID 43400021

IUPAC2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide
SMILESCCN1CCC(NCC(=O)NC(C)C)CC1
InChIInChI=1S/C12H25N3O/c1-4-15-7-5-11(6-8-15)13-9-12(16)14-10(2)3/h10-11,13H,4-9H2,1-3H3,(H,14,16)
InChIKeyHZJLHNBSRINZCT-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.58
Rot. Bonds5

About 2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide

2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide (PubChem CID 43400021) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is 2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide
PubChem CID43400021
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC Name2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide
SMILESCCN1CCC(NCC(=O)NC(C)C)CC1
InChIInChI=1S/C12H25N3O/c1-4-15-7-5-11(6-8-15)13-9-12(16)14-10(2)3/h10-11,13H,4-9H2,1-3H3,(H,14,16)
InChIKeyHZJLHNBSRINZCT-UHFFFAOYSA-N
XLogP0.58
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1-acetylpiperidin-4-yl)amino]-N-propan-2-ylacetamide
CID 43224142
ethyl 4-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]piperidine-1-carboxylate
CID 28586107
2-(cyclohexylamino)-N-propan-2-ylacetamide
CID 28565007
2-[(1-ethylpiperidin-4-yl)amino]acetic acid
CID 43135208
2-(1-ethylpiperidin-4-yl)-N-propan-2-ylacetamide
CID 177202345
N-pentan-2-yl-2-[(1-propylpiperidin-4-yl)amino]acetamide
CID 60695886
N-tert-butyl-2-[(1-ethylazepan-4-yl)amino]acetamide
CID 113293184
2-[(1-ethylazepan-4-yl)amino]acetic acid
CID 65074488
2-(piperidin-4-ylamino)-N-propan-2-ylacetamide
CID 61016594
N-propan-2-yl-3-[4-(propylamino)piperidin-1-yl]propanamide
CID 62624983
N-benzyl-2-[(1-ethylazepan-4-yl)amino]acetamide
CID 65073911
2-(cyclohexylamino)-1-(4-ethylpiperazin-1-yl)ethanone
CID 108993559

Frequently Asked Questions

What is the IUPAC name of 2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide (CID 43400021) is 2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide is CCN1CCC(NCC(=O)NC(C)C)CC1.
What is the InChIKey of 2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide?
The InChIKey is HZJLHNBSRINZCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-4-15-7-5-11(6-8-15)13-9-12(16)14-10(2)3/h10-11,13H,4-9H2,1-3H3,(H,14,16).
What are the key properties of 2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide?
2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide has a molecular weight of 227.35 g/mol, XLogP of 0.58, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-ethylpiperidin-4-yl)amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 43400021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).