N,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide

C15H27N5O — CID 106780057

IUPACN,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide
SMILESCC(C)Cn1ncnc1CC1CCNC(C(=O)N(C)C)C1
InChIInChI=1S/C15H27N5O/c1-11(2)9-20-14(17-10-18-20)8-12-5-6-16-13(7-12)15(21)19(3)4/h10-13,16H,5-9H2,1-4H3
InChIKeyXDBNFRGPVPXQEW-UHFFFAOYSA-N
MW293.42 g/mol
LogP0.93
Rot. Bonds5

About N,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide

N,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide (PubChem CID 106780057) has the molecular formula C15H27N5O and a molecular weight of 293.42 g/mol. Its IUPAC name is N,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide
PubChem CID106780057
Molecular FormulaC15H27N5O
Molecular Weight293.42 g/mol
Exact Mass293.22
IUPAC NameN,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide
SMILESCC(C)Cn1ncnc1CC1CCNC(C(=O)N(C)C)C1
InChIInChI=1S/C15H27N5O/c1-11(2)9-20-14(17-10-18-20)8-12-5-6-16-13(7-12)15(21)19(3)4/h10-13,16H,5-9H2,1-4H3
InChIKeyXDBNFRGPVPXQEW-UHFFFAOYSA-N
XLogP0.93
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.42
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-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

4-[(3-ethyl-1-methylpyrazol-5-yl)methyl]-N,N-dimethylpiperidine-2-carboxamide
CID 106779974
2-methyl-4-[(2-propan-2-yl-1,2,4-triazol-3-yl)methyl]piperidine
CID 106780031
1-[2-(2-methylpropyl)-1,2,4-triazol-3-yl]-4-piperidin-3-ylbutan-2-one
CID 116562412
[2-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]cyclobutyl]methanamine
CID 81011154
N,N-dimethyl-4-octylpiperidine-2-carboxamide
CID 106778464
4-hexyl-N,N-dimethylpiperidine-2-carboxamide
CID 106778401
(2R)-N,N-dimethylazetidine-2-carboxamide
CID 124537269
N-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106640259
1-cyclohexyl-N-methyl-3-[2-(2-methylpropyl)-1,2,4-triazol-3-yl]propan-2-amine
CID 104999870
1,1-difluoro-3-[2-(2-methylpropyl)-1,2,4-triazol-3-yl]propan-2-one
CID 112574058
4-ethyl-N-methyl-N-(4-methylpentan-2-yl)piperidine-2-carboxamide
CID 114428433
1-[1-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]cyclopropyl]ethanone
CID 106796910

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide?
The IUPAC name of N,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide (CID 106780057) is N,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide?
The canonical SMILES for N,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide is CC(C)Cn1ncnc1CC1CCNC(C(=O)N(C)C)C1.
What is the InChIKey of N,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide?
The InChIKey is XDBNFRGPVPXQEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-11(2)9-20-14(17-10-18-20)8-12-5-6-16-13(7-12)15(21)19(3)4/h10-13,16H,5-9H2,1-4H3.
What are the key properties of N,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide?
N,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide has a molecular weight of 293.42 g/mol, XLogP of 0.93, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]piperidine-2-carboxamide is sourced from PubChem (CID 106780057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).