4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide

C18H24N6O2 — CID 155874156

IUPAC4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide
SMILESCN(C)C(=O)C1(Nc2ccccc2)CCN(C(=O)Cn2ccnn2)CC1
InChIInChI=1S/C18H24N6O2/c1-22(2)17(26)18(20-15-6-4-3-5-7-15)8-11-23(12-9-18)16(25)14-24-13-10-19-21-24/h3-7,10,13,20H,8-9,11-12,14H2,1-2H3
InChIKeyCGVRTNAHBVDLMX-UHFFFAOYSA-N
MW356.43 g/mol
LogP0.84
Rot. Bonds5

About 4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide

4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide (PubChem CID 155874156) has the molecular formula C18H24N6O2 and a molecular weight of 356.43 g/mol. Its IUPAC name is 4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide
PubChem CID155874156
Molecular FormulaC18H24N6O2
Molecular Weight356.43 g/mol
Exact Mass356.20
IUPAC Name4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide
SMILESCN(C)C(=O)C1(Nc2ccccc2)CCN(C(=O)Cn2ccnn2)CC1
InChIInChI=1S/C18H24N6O2/c1-22(2)17(26)18(20-15-6-4-3-5-7-15)8-11-23(12-9-18)16(25)14-24-13-10-19-21-24/h3-7,10,13,20H,8-9,11-12,14H2,1-2H3
InChIKeyCGVRTNAHBVDLMX-UHFFFAOYSA-N
XLogP0.84
TPSA83.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-anilino-N,N-dimethyl-1-(2-methylpyrazole-3-carbonyl)piperidine-4-carboxamide
CID 155874172
4-anilino-N,N-dimethyl-1-(6-methylpyridine-2-carbonyl)piperidine-4-carboxamide
CID 155873229
4-anilino-N,N-dimethyl-1-(2-methyl-1,3-thiazole-4-carbonyl)piperidine-4-carboxamide
CID 155873454
4-anilino-1-[(2-fluorophenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 155879946
1-acetyl-4-anilinopiperidine-4-carboxylic acid
CID 114239013
4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 155873379
4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 155878897
3-propan-2-yl-1-[2-(triazol-1-yl)acetyl]pyrrolidine-3-carboxylic acid
CID 106982529
4-[2-(triazol-1-yl)acetyl]piperazine-2,6-dione
CID 115348358
3-anilino-N,N-dimethyl-1-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 155879167
1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide
CID 155879122
1-(8-benzyl-2,8-diazaspiro[5.5]undecan-2-yl)-2-(triazol-1-yl)ethanone
CID 119073733

Frequently Asked Questions

What is the IUPAC name of 4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide?
The IUPAC name of 4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide (CID 155874156) is 4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide.
What is the SMILES notation for 4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide?
The canonical SMILES for 4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide is CN(C)C(=O)C1(Nc2ccccc2)CCN(C(=O)Cn2ccnn2)CC1.
What is the InChIKey of 4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide?
The InChIKey is CGVRTNAHBVDLMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N6O2/c1-22(2)17(26)18(20-15-6-4-3-5-7-15)8-11-23(12-9-18)16(25)14-24-13-10-19-21-24/h3-7,10,13,20H,8-9,11-12,14H2,1-2H3.
What are the key properties of 4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide?
4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide has a molecular weight of 356.43 g/mol, XLogP of 0.84, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide is sourced from PubChem (CID 155874156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).