5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide

C15H23N5O — CID 155953426

IUPAC5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide
SMILESCn1c(NC(CCC(C)(C)C)C(N)=O)nc2cnccc21
InChIInChI=1S/C15H23N5O/c1-15(2,3)7-5-10(13(16)21)18-14-19-11-9-17-8-6-12(11)20(14)4/h6,8-10H,5,7H2,1-4H3,(H2,16,21)(H,18,19)
InChIKeySWKZSQYSOUSKRH-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.06
Rot. Bonds5

About 5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide

5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide (PubChem CID 155953426) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is 5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide.

Molecular Properties

Compound Name5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide
PubChem CID155953426
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC Name5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide
SMILESCn1c(NC(CCC(C)(C)C)C(N)=O)nc2cnccc21
InChIInChI=1S/C15H23N5O/c1-15(2,3)7-5-10(13(16)21)18-14-19-11-9-17-8-6-12(11)20(14)4/h6,8-10H,5,7H2,1-4H3,(H2,16,21)(H,18,19)
InChIKeySWKZSQYSOUSKRH-UHFFFAOYSA-N
XLogP2.06
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide?
The IUPAC name of 5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide (CID 155953426) is 5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide.
What is the SMILES notation for 5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide?
The canonical SMILES for 5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide is Cn1c(NC(CCC(C)(C)C)C(N)=O)nc2cnccc21.
What is the InChIKey of 5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide?
The InChIKey is SWKZSQYSOUSKRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-15(2,3)7-5-10(13(16)21)18-14-19-11-9-17-8-6-12(11)20(14)4/h6,8-10H,5,7H2,1-4H3,(H2,16,21)(H,18,19).
What are the key properties of 5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide?
5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide has a molecular weight of 289.38 g/mol, XLogP of 2.06, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-2-[(1-methylimidazo[4,5-c]pyridin-2-yl)amino]hexanamide is sourced from PubChem (CID 155953426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).