6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride

C20H30ClN7O2 — CID 120644540

IUPAC6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride
SMILESCC1CN(c2ccc(C(=O)Nc3nc(C4CCNCC4)nn3C)cn2)CC(C)O1.Cl
InChIInChI=1S/C20H29N7O2.ClH/c1-13-11-27(12-14(2)29-13)17-5-4-16(10-22-17)19(28)24-20-23-18(25-26(20)3)15-6-8-21-9-7-15;/h4-5,10,13-15,21H,6-9,11-12H2,1-3H3,(H,23,24,25,28);1H
InChIKeyNIPZVPBJAAMJTA-UHFFFAOYSA-N
MW435.96 g/mol
LogP1.96
Rot. Bonds4

About 6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride

6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride (PubChem CID 120644540) has the molecular formula C20H30ClN7O2 and a molecular weight of 435.96 g/mol. Its IUPAC name is 6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride.

Molecular Properties

Compound Name6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride
PubChem CID120644540
Molecular FormulaC20H30ClN7O2
Molecular Weight435.96 g/mol
Exact Mass435.21
IUPAC Name6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride
SMILESCC1CN(c2ccc(C(=O)Nc3nc(C4CCNCC4)nn3C)cn2)CC(C)O1.Cl
InChIInChI=1S/C20H29N7O2.ClH/c1-13-11-27(12-14(2)29-13)17-5-4-16(10-22-17)19(28)24-20-23-18(25-26(20)3)15-6-8-21-9-7-15;/h4-5,10,13-15,21H,6-9,11-12H2,1-3H3,(H,23,24,25,28);1H
InChIKeyNIPZVPBJAAMJTA-UHFFFAOYSA-N
XLogP1.96
TPSA97.20 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.96
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride with MolForge

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Launch Full Analysis

Related Compounds

4-acetamido-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)benzamide
CID 120644889
N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)-4-propylbenzamide;hydrochloride
CID 120644118
4-(difluoromethylsulfanyl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)benzamide;hydrochloride
CID 120643906
1-N-(2,2-dimethylpropyl)-4-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)benzene-1,4-dicarboxamide
CID 120642634
4-(ethylsulfanylmethyl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)benzamide;hydrochloride
CID 120643371
[6-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-3-pyridinyl]-piperazin-1-ylmethanone
CID 124695718
N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)-3-phenoxybenzamide;hydrochloride
CID 120641846
3,4,5-trimethoxy-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)benzamide
CID 120644463
2,3-difluoro-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)benzamide;hydrochloride
CID 120643936
4-chloro-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)-3-(trifluoromethyl)benzamide;hydrochloride
CID 120642156
3-(difluoromethoxy)-4-methoxy-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)benzamide;hydrochloride
CID 120644384
1-methyl-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrrole-2-carboxamide
CID 120643132

Frequently Asked Questions

What is the IUPAC name of 6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride?
The IUPAC name of 6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride (CID 120644540) is 6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride.
What is the SMILES notation for 6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride?
The canonical SMILES for 6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride is CC1CN(c2ccc(C(=O)Nc3nc(C4CCNCC4)nn3C)cn2)CC(C)O1.Cl.
What is the InChIKey of 6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride?
The InChIKey is NIPZVPBJAAMJTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29N7O2.ClH/c1-13-11-27(12-14(2)29-13)17-5-4-16(10-22-17)19(28)24-20-23-18(25-26(20)3)15-6-8-21-9-7-15;/h4-5,10,13-15,21H,6-9,11-12H2,1-3H3,(H,23,24,25,28);1H.
What are the key properties of 6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride?
6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride has a molecular weight of 435.96 g/mol, XLogP of 1.96, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,6-dimethylmorpholin-4-yl)-N-(2-methyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyridine-3-carboxamide;hydrochloride is sourced from PubChem (CID 120644540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).