N-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide

C11H19N5O — CID 60807405

IUPACN-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide
SMILESCCN(C(=O)Cn1cncn1)C1CCCNC1
InChIInChI=1S/C11H19N5O/c1-2-16(10-4-3-5-12-6-10)11(17)7-15-9-13-8-14-15/h8-10,12H,2-7H2,1H3
InChIKeyJUYXOSPKLQKZRU-UHFFFAOYSA-N
MW237.31 g/mol
LogP-0.12
Rot. Bonds4

About N-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide

N-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide (PubChem CID 60807405) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is N-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide.

Molecular Properties

Compound NameN-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide
PubChem CID60807405
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC NameN-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide
SMILESCCN(C(=O)Cn1cncn1)C1CCCNC1
InChIInChI=1S/C11H19N5O/c1-2-16(10-4-3-5-12-6-10)11(17)7-15-9-13-8-14-15/h8-10,12H,2-7H2,1H3
InChIKeyJUYXOSPKLQKZRU-UHFFFAOYSA-N
XLogP-0.12
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 5-0.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(4-methylpiperidin-1-yl)ethyl]-2-(1,2,4-triazol-1-yl)propanamide
CID 45823979
N-(2-piperidin-1-ylethyl)-2-(1,2,4-triazol-1-yl)propanamide
CID 45893430
1-(4-Propan-2-ylpiperazin-1-yl)-2-(1,2,4-triazol-1-yl)propan-1-one
CID 53500648
N-[3-(2-oxoazepan-1-yl)propyl]-2-(1,2,4-triazol-1-yl)propanamide
CID 53504334
3-pyrrolidin-1-yl-N-[3-(1,2,4-triazol-1-yl)propyl]piperidine-1-carboxamide
CID 53504535
4-piperidin-1-yl-N-[3-(1,2,4-triazol-1-yl)propyl]piperidine-1-carboxamide
CID 53517842
N-(3-morpholin-4-ylpropyl)-2-(1,2,4-triazol-1-yl)propanamide
CID 53518710
N-(2-morpholin-4-ylethyl)-2-(1,2,4-triazol-1-yl)propanamide
CID 53522715
1-(4-Acetylpiperazin-1-yl)-2-(1,2,4-triazol-1-yl)propan-1-one
CID 53525550
N-(1-ethylpiperidin-4-yl)-2-[2-(1,2,4-triazol-1-ylmethyl)piperidin-1-yl]acetamide
CID 53575276
N-(1-cyclopropylpiperidin-4-yl)-2-[2-(1,2,4-triazol-1-ylmethyl)piperidin-1-yl]acetamide
CID 53575294
N-(1-ethylpiperidin-4-yl)-2-[2-(1,2,4-triazol-1-ylmethyl)pyrrolidin-1-yl]acetamide
CID 53587759

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide?
The IUPAC name of N-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide (CID 60807405) is N-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide.
What is the SMILES notation for N-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide?
The canonical SMILES for N-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide is CCN(C(=O)Cn1cncn1)C1CCCNC1.
What is the InChIKey of N-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide?
The InChIKey is JUYXOSPKLQKZRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-2-16(10-4-3-5-12-6-10)11(17)7-15-9-13-8-14-15/h8-10,12H,2-7H2,1H3.
What are the key properties of N-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide?
N-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide has a molecular weight of 237.31 g/mol, XLogP of -0.12, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-piperidin-3-yl-2-(1,2,4-triazol-1-yl)acetamide is sourced from PubChem (CID 60807405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).