4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one

C14H22N4O — CID 106187264

IUPAC4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one
SMILESCC(C)Cc1nc2c(n1C1CNC(=O)C1)CCNC2
InChIInChI=1S/C14H22N4O/c1-9(2)5-13-17-11-8-15-4-3-12(11)18(13)10-6-14(19)16-7-10/h9-10,15H,3-8H2,1-2H3,(H,16,19)
InChIKeyGNFLQWFDRSSMDW-UHFFFAOYSA-N
MW262.36 g/mol
LogP0.79
Rot. Bonds3

About 4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one

4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one (PubChem CID 106187264) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one.

Molecular Properties

Compound Name4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one
PubChem CID106187264
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one
SMILESCC(C)Cc1nc2c(n1C1CNC(=O)C1)CCNC2
InChIInChI=1S/C14H22N4O/c1-9(2)5-13-17-11-8-15-4-3-12(11)18(13)10-6-14(19)16-7-10/h9-10,15H,3-8H2,1-2H3,(H,16,19)
InChIKeyGNFLQWFDRSSMDW-UHFFFAOYSA-N
XLogP0.79
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4,4-dimethylcyclohexyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857793
1-(2-methylcyclopropyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857931
1-(2-methoxycyclopentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857536
1-(4-methylpentyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857950
N,N-dimethyl-2-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]ethanamine
CID 64857881
1-(6-methylheptan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64859159
1-(1-cyclopropylbutan-2-yl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64857940
2-ethyl-1-(4-methylcyclohexyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856928
2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64858954
2-(2-methylpropyl)-1-(2-piperidin-1-ylethyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64859138
1-(4-methylphenyl)-2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 64856708
2-propyl-1-(2,2,3,3-tetramethylcyclopropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
CID 79350712

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one?
The IUPAC name of 4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one (CID 106187264) is 4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one.
What is the SMILES notation for 4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one?
The canonical SMILES for 4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one is CC(C)Cc1nc2c(n1C1CNC(=O)C1)CCNC2.
What is the InChIKey of 4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one?
The InChIKey is GNFLQWFDRSSMDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-9(2)5-13-17-11-8-15-4-3-12(11)18(13)10-6-14(19)16-7-10/h9-10,15H,3-8H2,1-2H3,(H,16,19).
What are the key properties of 4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one?
4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one has a molecular weight of 262.36 g/mol, XLogP of 0.79, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methylpropyl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridin-1-yl]pyrrolidin-2-one is sourced from PubChem (CID 106187264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).