N-[2-(dimethylamino)ethyl]-N-piperidin-4-ylcyclopropanecarboxamide

C13H25N3O — CID 141093299

IUPACN-[2-(dimethylamino)ethyl]-N-piperidin-4-ylcyclopropanecarboxamide
SMILESCN(C)CCN(C(=O)C1CC1)C1CCNCC1
InChIInChI=1S/C13H25N3O/c1-15(2)9-10-16(13(17)11-3-4-11)12-5-7-14-8-6-12/h11-12,14H,3-10H2,1-2H3
InChIKeyQBWWEGPHUHSJEP-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.54
Rot. Bonds5

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

N-[2-(dimethylamino)ethyl]-N-piperidin-4-ylcyclopropanecarboxamide (PubChem CID 141093299) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-N-piperidin-4-ylcyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-N-piperidin-4-ylcyclopropanecarboxamide
PubChem CID141093299
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC NameN-[2-(dimethylamino)ethyl]-N-piperidin-4-ylcyclopropanecarboxamide
SMILESCN(C)CCN(C(=O)C1CC1)C1CCNCC1
InChIInChI=1S/C13H25N3O/c1-15(2)9-10-16(13(17)11-3-4-11)12-5-7-14-8-6-12/h11-12,14H,3-10H2,1-2H3
InChIKeyQBWWEGPHUHSJEP-UHFFFAOYSA-N
XLogP0.54
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 61039700
N-(2-amino-2-oxoethyl)-N-pyrrolidin-3-ylcyclopropanecarboxamide
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N-cyclopentyl-N-ethylpiperidine-4-carboxamide;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-N-piperidin-4-ylcyclopropanecarboxamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-N-piperidin-4-ylcyclopropanecarboxamide (CID 141093299) is N-[2-(dimethylamino)ethyl]-N-piperidin-4-ylcyclopropanecarboxamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-N-piperidin-4-ylcyclopropanecarboxamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-N-piperidin-4-ylcyclopropanecarboxamide is CN(C)CCN(C(=O)C1CC1)C1CCNCC1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-N-piperidin-4-ylcyclopropanecarboxamide?
The InChIKey is QBWWEGPHUHSJEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-15(2)9-10-16(13(17)11-3-4-11)12-5-7-14-8-6-12/h11-12,14H,3-10H2,1-2H3.
What are the key properties of N-[2-(dimethylamino)ethyl]-N-piperidin-4-ylcyclopropanecarboxamide?
N-[2-(dimethylamino)ethyl]-N-piperidin-4-ylcyclopropanecarboxamide has a molecular weight of 239.36 g/mol, XLogP of 0.54, 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-ylcyclopropanecarboxamide is sourced from PubChem (CID 141093299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).