N,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine

C17H20N6 — CID 134379442

IUPACN,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine
SMILESCNc1cnc(C)c(-c2cc3[nH]cnc3c(N3CCCC3)n2)c1
InChIInChI=1S/C17H20N6/c1-11-13(7-12(18-2)9-19-11)14-8-15-16(21-10-20-15)17(22-14)23-5-3-4-6-23/h7-10,18H,3-6H2,1-2H3,(H,20,21)
InChIKeyTVBUCYVRJZNTHU-UHFFFAOYSA-N
MW308.39 g/mol
LogP2.97
Rot. Bonds3

About N,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine

N,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine (PubChem CID 134379442) has the molecular formula C17H20N6 and a molecular weight of 308.39 g/mol. Its IUPAC name is N,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine.

Molecular Properties

Compound NameN,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine
PubChem CID134379442
Molecular FormulaC17H20N6
Molecular Weight308.39 g/mol
Exact Mass308.17
IUPAC NameN,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine
SMILESCNc1cnc(C)c(-c2cc3[nH]cnc3c(N3CCCC3)n2)c1
InChIInChI=1S/C17H20N6/c1-11-13(7-12(18-2)9-19-11)14-8-15-16(21-10-20-15)17(22-14)23-5-3-4-6-23/h7-10,18H,3-6H2,1-2H3,(H,20,21)
InChIKeyTVBUCYVRJZNTHU-UHFFFAOYSA-N
XLogP2.97
TPSA69.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine?
The IUPAC name of N,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine (CID 134379442) is N,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine.
What is the SMILES notation for N,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine?
The canonical SMILES for N,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine is CNc1cnc(C)c(-c2cc3[nH]cnc3c(N3CCCC3)n2)c1.
What is the InChIKey of N,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine?
The InChIKey is TVBUCYVRJZNTHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N6/c1-11-13(7-12(18-2)9-19-11)14-8-15-16(21-10-20-15)17(22-14)23-5-3-4-6-23/h7-10,18H,3-6H2,1-2H3,(H,20,21).
What are the key properties of N,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine?
N,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine has a molecular weight of 308.39 g/mol, XLogP of 2.97, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-5-(4-pyrrolidin-1-yl-1H-imidazo[4,5-c]pyridin-6-yl)pyridin-3-amine is sourced from PubChem (CID 134379442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).