N-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine

C19H23N3O — CID 71873022

IUPACN-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine
SMILESCc1cn2c(n1)C(CNCC1=Cc3ccccc3OC1)CCC2
InChIInChI=1S/C19H23N3O/c1-14-12-22-8-4-6-17(19(22)21-14)11-20-10-15-9-16-5-2-3-7-18(16)23-13-15/h2-3,5,7,9,12,17,20H,4,6,8,10-11,13H2,1H3
InChIKeyZMIJGRPKULWBMC-UHFFFAOYSA-N
MW309.41 g/mol
LogP3.13
Rot. Bonds4

About N-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine

N-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine (PubChem CID 71873022) has the molecular formula C19H23N3O and a molecular weight of 309.41 g/mol. Its IUPAC name is N-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine.

Molecular Properties

Compound NameN-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine
PubChem CID71873022
Molecular FormulaC19H23N3O
Molecular Weight309.41 g/mol
Exact Mass309.18
IUPAC NameN-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine
SMILESCc1cn2c(n1)C(CNCC1=Cc3ccccc3OC1)CCC2
InChIInChI=1S/C19H23N3O/c1-14-12-22-8-4-6-17(19(22)21-14)11-20-10-15-9-16-5-2-3-7-18(16)23-13-15/h2-3,5,7,9,12,17,20H,4,6,8,10-11,13H2,1H3
InChIKeyZMIJGRPKULWBMC-UHFFFAOYSA-N
XLogP3.13
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine?
The IUPAC name of N-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine (CID 71873022) is N-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine.
What is the SMILES notation for N-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine?
The canonical SMILES for N-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine is Cc1cn2c(n1)C(CNCC1=Cc3ccccc3OC1)CCC2.
What is the InChIKey of N-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine?
The InChIKey is ZMIJGRPKULWBMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O/c1-14-12-22-8-4-6-17(19(22)21-14)11-20-10-15-9-16-5-2-3-7-18(16)23-13-15/h2-3,5,7,9,12,17,20H,4,6,8,10-11,13H2,1H3.
What are the key properties of N-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine?
N-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine has a molecular weight of 309.41 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2H-chromen-3-ylmethyl)-1-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine is sourced from PubChem (CID 71873022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).