N-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen

C18H24N6 — CID 142337025

IUPACN-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen
SMILESCC1=NC(N2CCCCC2)=CCC(Nc2ccn3ccnc3c2)=N1.[H][H]
InChIInChI=1S/C18H22N6.H2/c1-14-20-16(5-6-17(21-14)23-9-3-2-4-10-23)22-15-7-11-24-12-8-19-18(24)13-15;/h6-8,11-13H,2-5,9-10H2,1H3,(H,20,21,22);1H
InChIKeyAOUWFVZXXNXJIF-UHFFFAOYSA-N
MW324.43 g/mol
LogP3.54
Rot. Bonds2

About N-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen

N-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen (PubChem CID 142337025) has the molecular formula C18H24N6 and a molecular weight of 324.43 g/mol. Its IUPAC name is N-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen.

Molecular Properties

Compound NameN-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen
PubChem CID142337025
Molecular FormulaC18H24N6
Molecular Weight324.43 g/mol
Exact Mass324.21
IUPAC NameN-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen
SMILESCC1=NC(N2CCCCC2)=CCC(Nc2ccn3ccnc3c2)=N1.[H][H]
InChIInChI=1S/C18H22N6.H2/c1-14-20-16(5-6-17(21-14)23-9-3-2-4-10-23)22-15-7-11-24-12-8-19-18(24)13-15;/h6-8,11-13H,2-5,9-10H2,1H3,(H,20,21,22);1H
InChIKeyAOUWFVZXXNXJIF-UHFFFAOYSA-N
XLogP3.54
TPSA57.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen?
The IUPAC name of N-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen (CID 142337025) is N-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen.
What is the SMILES notation for N-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen?
The canonical SMILES for N-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen is CC1=NC(N2CCCCC2)=CCC(Nc2ccn3ccnc3c2)=N1.[H][H].
What is the InChIKey of N-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen?
The InChIKey is AOUWFVZXXNXJIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N6.H2/c1-14-20-16(5-6-17(21-14)23-9-3-2-4-10-23)22-15-7-11-24-12-8-19-18(24)13-15;/h6-8,11-13H,2-5,9-10H2,1H3,(H,20,21,22);1H.
What are the key properties of N-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen?
N-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen has a molecular weight of 324.43 g/mol, XLogP of 3.54, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-7-piperidin-1-yl-5H-1,3-diazepin-4-yl)imidazo[1,2-a]pyridin-7-amine;molecular hydrogen is sourced from PubChem (CID 142337025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).