4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol

C14H17N3O — CID 117156988

IUPAC4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol
SMILESNC1CCn2cc(Cc3ccc(O)cc3)nc2C1
InChIInChI=1S/C14H17N3O/c15-11-5-6-17-9-12(16-14(17)8-11)7-10-1-3-13(18)4-2-10/h1-4,9,11,18H,5-8,15H2
InChIKeyMDHHGGQRHGILQW-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.45
Rot. Bonds2

About 4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol

4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol (PubChem CID 117156988) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol.

Molecular Properties

Compound Name4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol
PubChem CID117156988
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol
SMILESNC1CCn2cc(Cc3ccc(O)cc3)nc2C1
InChIInChI=1S/C14H17N3O/c15-11-5-6-17-9-12(16-14(17)8-11)7-10-1-3-13(18)4-2-10/h1-4,9,11,18H,5-8,15H2
InChIKeyMDHHGGQRHGILQW-UHFFFAOYSA-N
XLogP1.45
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol?
The IUPAC name of 4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol (CID 117156988) is 4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol.
What is the SMILES notation for 4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol?
The canonical SMILES for 4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol is NC1CCn2cc(Cc3ccc(O)cc3)nc2C1.
What is the InChIKey of 4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol?
The InChIKey is MDHHGGQRHGILQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c15-11-5-6-17-9-12(16-14(17)8-11)7-10-1-3-13(18)4-2-10/h1-4,9,11,18H,5-8,15H2.
What are the key properties of 4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol?
4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol has a molecular weight of 243.31 g/mol, XLogP of 1.45, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(7-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)methyl]phenol is sourced from PubChem (CID 117156988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).