N,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide

C13H25N3O2 — CID 106277030

IUPACN,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide
SMILESCNC(=O)C(C)(C)CNC(=O)CC1CCNCC1
InChIInChI=1S/C13H25N3O2/c1-13(2,12(18)14-3)9-16-11(17)8-10-4-6-15-7-5-10/h10,15H,4-9H2,1-3H3,(H,14,18)(H,16,17)
InChIKeyPYBCGTGSLPKWQM-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.26
Rot. Bonds5

About N,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide

N,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide (PubChem CID 106277030) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is N,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide.

Molecular Properties

Compound NameN,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide
PubChem CID106277030
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC NameN,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide
SMILESCNC(=O)C(C)(C)CNC(=O)CC1CCNCC1
InChIInChI=1S/C13H25N3O2/c1-13(2,12(18)14-3)9-16-11(17)8-10-4-6-15-7-5-10/h10,15H,4-9H2,1-3H3,(H,14,18)(H,16,17)
InChIKeyPYBCGTGSLPKWQM-UHFFFAOYSA-N
XLogP0.26
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N,2,2-trimethyl-3-[(2-thiomorpholin-3-ylacetyl)amino]propanamide
CID 114167326
2-piperidin-4-yl-N-prop-2-ynylacetamide
CID 61028682
N-(1-methoxy-2-methylpropan-2-yl)-2-piperidin-4-ylacetamide
CID 115738831
N-(5-hydroxy-2,2-dimethylpentyl)-2-pyrrolidin-3-ylacetamide
CID 106148292
2-cycloheptyl-N-(piperidin-4-ylmethyl)acetamide
CID 115736681
N-methylsulfanyl-2-piperidin-4-ylacetamide
CID 145013243
N-methyl-2-(piperidin-4-ylmethylamino)acetamide
CID 79708074
N-[(2S)-2-methylsulfanylpropyl]-2-piperidin-4-ylacetamide
CID 99596160
N-[(4,6-dimethylpyrimidin-2-yl)methyl]-2-piperidin-4-ylacetamide
CID 92632152
2,2-dimethyl-3-(3-pyrrolidin-3-ylpropanoylamino)propanamide
CID 103859907
N-methyl-2-(piperidin-4-ylmethoxy)acetamide
CID 39062927
3-[(2-piperidin-4-ylacetyl)amino]-N-propan-2-ylpropanamide
CID 113266104

Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide?
The IUPAC name of N,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide (CID 106277030) is N,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide.
What is the SMILES notation for N,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide?
The canonical SMILES for N,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide is CNC(=O)C(C)(C)CNC(=O)CC1CCNCC1.
What is the InChIKey of N,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide?
The InChIKey is PYBCGTGSLPKWQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-13(2,12(18)14-3)9-16-11(17)8-10-4-6-15-7-5-10/h10,15H,4-9H2,1-3H3,(H,14,18)(H,16,17).
What are the key properties of N,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide?
N,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide has a molecular weight of 255.36 g/mol, XLogP of 0.26, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-3-[(2-piperidin-4-ylacetyl)amino]propanamide is sourced from PubChem (CID 106277030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).