N-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide

C14H25N5O2 — CID 131941619

IUPACN-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide
SMILESCOCC(C)NC(=O)C1CCN(CCn2cnnc2)CC1
InChIInChI=1S/C14H25N5O2/c1-12(9-21-2)17-14(20)13-3-5-18(6-4-13)7-8-19-10-15-16-11-19/h10-13H,3-9H2,1-2H3,(H,17,20)
InChIKeyVWLLKCQSBWBAST-UHFFFAOYSA-N
MW295.39 g/mol
LogP0.14
Rot. Bonds7

About N-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide

N-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide (PubChem CID 131941619) has the molecular formula C14H25N5O2 and a molecular weight of 295.39 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide
PubChem CID131941619
Molecular FormulaC14H25N5O2
Molecular Weight295.39 g/mol
Exact Mass295.20
IUPAC NameN-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide
SMILESCOCC(C)NC(=O)C1CCN(CCn2cnnc2)CC1
InChIInChI=1S/C14H25N5O2/c1-12(9-21-2)17-14(20)13-3-5-18(6-4-13)7-8-19-10-15-16-11-19/h10-13H,3-9H2,1-2H3,(H,17,20)
InChIKeyVWLLKCQSBWBAST-UHFFFAOYSA-N
XLogP0.14
TPSA72.28 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-methoxypropan-2-yl)-1-propan-2-ylpiperidine-4-carboxamide
CID 167004447
1-[(4-methoxyphenyl)methyl]-N-(1-methoxypropan-2-yl)piperidine-4-carboxamide
CID 51361839
1-[(2-chlorophenyl)methyl]-N-[(2S)-1-methoxypropan-2-yl]piperidine-4-carboxamide
CID 28630305
N-(1-methoxypropan-2-yl)-1-(pyridin-3-ylmethyl)piperidine-4-carboxamide
CID 4614545
1-(2-fluorophenyl)-N-(1-methoxypropan-2-yl)piperidine-4-carboxamide
CID 17152731
N-(1-methoxypropan-2-yl)-1-[[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-4-carboxamide
CID 43926789
N-(1-methoxypropan-2-yl)-1-[(4-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide
CID 51361898
N-(1-methoxypropan-2-yl)-1-[2-(2,3,6-trimethylphenoxy)acetyl]piperidine-4-carboxamide
CID 46982810
1-benzylsulfonyl-N-[(2S)-1-methoxypropan-2-yl]piperidine-4-carboxamide
CID 29204159
N-(1-methoxypropan-2-yl)-1-(4-propan-2-ylphenyl)sulfonylpiperidine-4-carboxamide
CID 51144176
1-(4-methoxyphenyl)sulfonyl-N-[(2R)-1-methoxypropan-2-yl]piperidine-4-carboxamide
CID 7248361
1-(2-amino-5-ethylpyrimidin-4-yl)-N-(1-methoxypropan-2-yl)piperidine-4-carboxamide
CID 137343270

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide?
The IUPAC name of N-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide (CID 131941619) is N-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide?
The canonical SMILES for N-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide is COCC(C)NC(=O)C1CCN(CCn2cnnc2)CC1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide?
The InChIKey is VWLLKCQSBWBAST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5O2/c1-12(9-21-2)17-14(20)13-3-5-18(6-4-13)7-8-19-10-15-16-11-19/h10-13H,3-9H2,1-2H3,(H,17,20).
What are the key properties of N-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide?
N-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide has a molecular weight of 295.39 g/mol, XLogP of 0.14, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-1-[2-(1,2,4-triazol-4-yl)ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 131941619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).