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

C17H30N4 — CID 64858954

IUPAC2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCC(C)Cc1nc2c(n1C(C)CN1CCCC1)CCNC2
InChIInChI=1S/C17H30N4/c1-13(2)10-17-19-15-11-18-7-6-16(15)21(17)14(3)12-20-8-4-5-9-20/h13-14,18H,4-12H2,1-3H3
InChIKeyRDELARMNKDFMFO-UHFFFAOYSA-N
MW290.45 g/mol
LogP2.38
Rot. Bonds5

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

2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 64858954) has the molecular formula C17H30N4 and a molecular weight of 290.45 g/mol. Its IUPAC name is 2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID64858954
Molecular FormulaC17H30N4
Molecular Weight290.45 g/mol
Exact Mass290.25
IUPAC Name2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCC(C)Cc1nc2c(n1C(C)CN1CCCC1)CCNC2
InChIInChI=1S/C17H30N4/c1-13(2)10-17-19-15-11-18-7-6-16(15)21(17)14(3)12-20-8-4-5-9-20/h13-14,18H,4-12H2,1-3H3
InChIKeyRDELARMNKDFMFO-UHFFFAOYSA-N
XLogP2.38
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.45
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 64858954) is 2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is CC(C)Cc1nc2c(n1C(C)CN1CCCC1)CCNC2.
What is the InChIKey of 2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is RDELARMNKDFMFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-13(2)10-17-19-15-11-18-7-6-16(15)21(17)14(3)12-20-8-4-5-9-20/h13-14,18H,4-12H2,1-3H3.
What are the key properties of 2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 290.45 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropyl)-1-(1-pyrrolidin-1-ylpropan-2-yl)-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 64858954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).