N-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide

C12H25N3O — CID 69300106

IUPACN-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide
SMILESCC(=O)N(CCN(C)C)CC1CCNCC1
InChIInChI=1S/C12H25N3O/c1-11(16)15(9-8-14(2)3)10-12-4-6-13-7-5-12/h12-13H,4-10H2,1-3H3
InChIKeyZHHGCPGLTQJEPA-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.40
Rot. Bonds5

About N-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide

N-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide (PubChem CID 69300106) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide
PubChem CID69300106
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC NameN-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide
SMILESCC(=O)N(CCN(C)C)CC1CCNCC1
InChIInChI=1S/C12H25N3O/c1-11(16)15(9-8-14(2)3)10-12-4-6-13-7-5-12/h12-13H,4-10H2,1-3H3
InChIKeyZHHGCPGLTQJEPA-UHFFFAOYSA-N
XLogP0.40
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(piperidin-4-ylmethyl)acetamide;hydrochloride
CID 118998343
N'-cyclopropyl-N,N-dimethyl-N'-(piperidin-4-ylmethyl)ethane-1,2-diamine
CID 79714194
N-ethyl-3-methyl-N-(piperidin-4-ylmethyl)but-2-enamide
CID 79721059
N-(cyclopropylmethyl)-N-propylacetamide
CID 59001159
N-ethyl-2-methyl-N-(piperidin-4-ylmethyl)propanamide
CID 79721124
N,N-dimethyl-1-piperidin-4-ylmethanamine;dihydrochloride
CID 23153381
azane;N,N-dimethyl-1-piperidin-4-ylmethanamine
CID 175907731
2-acetamido-N-ethyl-N-(piperidin-4-ylmethyl)acetamide
CID 79721132
N-[2-(dimethylamino)ethyl]-N-methyl-3-piperidin-4-ylpropanamide
CID 55227726
N-ethyl-2,2,3,3-tetramethyl-N-(piperidin-4-ylmethyl)cyclopropane-1-carboxamide
CID 79720902
2-ethyl-N-(piperidin-4-ylmethyl)-N-propylbutanamide
CID 79721437
N-(piperidin-4-ylmethyl)-N-propylcyclooctanecarboxamide
CID 79702518

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide (CID 69300106) is N-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide is CC(=O)N(CCN(C)C)CC1CCNCC1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide?
The InChIKey is ZHHGCPGLTQJEPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-11(16)15(9-8-14(2)3)10-12-4-6-13-7-5-12/h12-13H,4-10H2,1-3H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide?
N-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide has a molecular weight of 227.35 g/mol, XLogP of 0.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-N-(piperidin-4-ylmethyl)acetamide is sourced from PubChem (CID 69300106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).