N-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide

C13H23N5O — CID 122559105

IUPACN-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide
SMILESCc1nc2c([nH]1)CN(C(=O)NCC(C)N(C)C)CC2
InChIInChI=1S/C13H23N5O/c1-9(17(3)4)7-14-13(19)18-6-5-11-12(8-18)16-10(2)15-11/h9H,5-8H2,1-4H3,(H,14,19)(H,15,16)
InChIKeyAVXSUJMRLOBKBK-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.74
Rot. Bonds3

About N-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide

N-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide (PubChem CID 122559105) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is N-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide
PubChem CID122559105
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC NameN-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide
SMILESCc1nc2c([nH]1)CN(C(=O)NCC(C)N(C)C)CC2
InChIInChI=1S/C13H23N5O/c1-9(17(3)4)7-14-13(19)18-6-5-11-12(8-18)16-10(2)15-11/h9H,5-8H2,1-4H3,(H,14,19)(H,15,16)
InChIKeyAVXSUJMRLOBKBK-UHFFFAOYSA-N
XLogP0.74
TPSA64.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide?
The IUPAC name of N-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide (CID 122559105) is N-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide is Cc1nc2c([nH]1)CN(C(=O)NCC(C)N(C)C)CC2.
What is the InChIKey of N-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide?
The InChIKey is AVXSUJMRLOBKBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-9(17(3)4)7-14-13(19)18-6-5-11-12(8-18)16-10(2)15-11/h9H,5-8H2,1-4H3,(H,14,19)(H,15,16).
What are the key properties of N-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide?
N-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 0.74, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)propyl]-2-methyl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine-5-carboxamide is sourced from PubChem (CID 122559105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).