2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride

C12H27Cl2N3O — CID 119460245

IUPAC2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride
SMILESCCN(CC)CC(=O)NCC1CCCNC1.Cl.Cl
InChIInChI=1S/C12H25N3O.2ClH/c1-3-15(4-2)10-12(16)14-9-11-6-5-7-13-8-11;;/h11,13H,3-10H2,1-2H3,(H,14,16);2*1H
InChIKeyZDNZABDDAOPWON-UHFFFAOYSA-N
MW300.27 g/mol
LogP1.29
Rot. Bonds6

About 2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride

2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride (PubChem CID 119460245) has the molecular formula C12H27Cl2N3O and a molecular weight of 300.27 g/mol. Its IUPAC name is 2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride.

Molecular Properties

Compound Name2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride
PubChem CID119460245
Molecular FormulaC12H27Cl2N3O
Molecular Weight300.27 g/mol
Exact Mass299.15
IUPAC Name2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride
SMILESCCN(CC)CC(=O)NCC1CCCNC1.Cl.Cl
InChIInChI=1S/C12H25N3O.2ClH/c1-3-15(4-2)10-12(16)14-9-11-6-5-7-13-8-11;;/h11,13H,3-10H2,1-2H3,(H,14,16);2*1H
InChIKeyZDNZABDDAOPWON-UHFFFAOYSA-N
XLogP1.29
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.27
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(piperidin-3-ylmethyl)-N-propylbutanediamide;hydrochloride
CID 119463444
2-methylsulfanyl-N-(piperidin-3-ylmethyl)acetamide;hydrochloride
CID 119462298
N'-(piperidin-3-ylmethyl)-N-propylbutanediamide
CID 119463445
2,2-dimethyl-N-[2-oxo-2-(piperidin-3-ylmethylamino)ethyl]propanamide;hydrochloride
CID 119462428
2-[ethyl(piperidin-3-ylmethyl)amino]-N-[(4-fluorophenyl)methyl]acetamide;hydrochloride
CID 119929420
2-ethyl-N-(piperidin-3-ylmethyl)butanamide;hydrochloride
CID 119462909
N-(cyclopropylmethyl)-2-[piperidin-3-ylmethyl(propan-2-yl)amino]acetamide
CID 106637630
N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride
CID 119260134
4-N,4-N-diethyl-1-N-(piperidin-3-ylmethyl)benzene-1,4-dicarboxamide;hydrochloride
CID 119463375
N-(piperidin-3-ylmethyl)-2-(tetrazol-1-yl)acetamide;hydrochloride
CID 119260132
1-(piperidin-3-ylmethyl)-3-propan-2-ylurea
CID 43208690
N-(piperidin-3-ylmethyl)cyclohexanecarboxamide
CID 18069614

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride?
The IUPAC name of 2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride (CID 119460245) is 2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride.
What is the SMILES notation for 2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride?
The canonical SMILES for 2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride is CCN(CC)CC(=O)NCC1CCCNC1.Cl.Cl.
What is the InChIKey of 2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride?
The InChIKey is ZDNZABDDAOPWON-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O.2ClH/c1-3-15(4-2)10-12(16)14-9-11-6-5-7-13-8-11;;/h11,13H,3-10H2,1-2H3,(H,14,16);2*1H.
What are the key properties of 2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride?
2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride has a molecular weight of 300.27 g/mol, XLogP of 1.29, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-N-(piperidin-3-ylmethyl)acetamide;dihydrochloride is sourced from PubChem (CID 119460245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).