(3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine

C9H14ClN3 — CID 83869789

IUPAC(3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine
SMILESCc1nc(Cl)n2c1C(CN)CCC2
InChIInChI=1S/C9H14ClN3/c1-6-8-7(5-11)3-2-4-13(8)9(10)12-6/h7H,2-5,11H2,1H3
InChIKeyIIAUNNBSFOSGKL-UHFFFAOYSA-N
MW199.68 g/mol
LogP1.68
Rot. Bonds1

About (3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine

(3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine (PubChem CID 83869789) has the molecular formula C9H14ClN3 and a molecular weight of 199.68 g/mol. Its IUPAC name is (3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine.

Molecular Properties

Compound Name(3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine
PubChem CID83869789
Molecular FormulaC9H14ClN3
Molecular Weight199.68 g/mol
Exact Mass199.09
IUPAC Name(3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine
SMILESCc1nc(Cl)n2c1C(CN)CCC2
InChIInChI=1S/C9H14ClN3/c1-6-8-7(5-11)3-2-4-13(8)9(10)12-6/h7H,2-5,11H2,1H3
InChIKeyIIAUNNBSFOSGKL-UHFFFAOYSA-N
XLogP1.68
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.68
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine?
The IUPAC name of (3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine (CID 83869789) is (3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine.
What is the SMILES notation for (3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine?
The canonical SMILES for (3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine is Cc1nc(Cl)n2c1C(CN)CCC2.
What is the InChIKey of (3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine?
The InChIKey is IIAUNNBSFOSGKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14ClN3/c1-6-8-7(5-11)3-2-4-13(8)9(10)12-6/h7H,2-5,11H2,1H3.
What are the key properties of (3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine?
(3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine has a molecular weight of 199.68 g/mol, XLogP of 1.68, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-1-methyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-8-yl)methanamine is sourced from PubChem (CID 83869789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).