1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

C12H19N3 — CID 64856548

IUPAC1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCc1nc2c(n1CC1CCC1)CCNC2
InChIInChI=1S/C12H19N3/c1-9-14-11-7-13-6-5-12(11)15(9)8-10-3-2-4-10/h10,13H,2-8H2,1H3
InChIKeyMBKSTRUDCLZZII-UHFFFAOYSA-N
MW205.30 g/mol
LogP1.64
Rot. Bonds2

About 1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine

1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (PubChem CID 64856548) has the molecular formula C12H19N3 and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.

Molecular Properties

Compound Name1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
PubChem CID64856548
Molecular FormulaC12H19N3
Molecular Weight205.30 g/mol
Exact Mass205.16
IUPAC Name1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine
SMILESCc1nc2c(n1CC1CCC1)CCNC2
InChIInChI=1S/C12H19N3/c1-9-14-11-7-13-6-5-12(11)15(9)8-10-3-2-4-10/h10,13H,2-8H2,1H3
InChIKeyMBKSTRUDCLZZII-UHFFFAOYSA-N
XLogP1.64
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The IUPAC name of 1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine (CID 64856548) is 1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine.
What is the SMILES notation for 1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The canonical SMILES for 1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is Cc1nc2c(n1CC1CCC1)CCNC2.
What is the InChIKey of 1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
The InChIKey is MBKSTRUDCLZZII-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-9-14-11-7-13-6-5-12(11)15(9)8-10-3-2-4-10/h10,13H,2-8H2,1H3.
What are the key properties of 1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine?
1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine has a molecular weight of 205.30 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylmethyl)-2-methyl-4,5,6,7-tetrahydroimidazo[4,5-c]pyridine is sourced from PubChem (CID 64856548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).