4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol

C15H15N3O — CID 117145848

IUPAC4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol
SMILESNCc1cccn2c(Cc3ccc(O)cc3)ncc12
InChIInChI=1S/C15H15N3O/c16-9-12-2-1-7-18-14(12)10-17-15(18)8-11-3-5-13(19)6-4-11/h1-7,10,19H,8-9,16H2
InChIKeyFSYPDQDNAKPPSA-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.09
Rot. Bonds3

About 4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol

4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol (PubChem CID 117145848) has the molecular formula C15H15N3O and a molecular weight of 253.31 g/mol. Its IUPAC name is 4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol.

Molecular Properties

Compound Name4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol
PubChem CID117145848
Molecular FormulaC15H15N3O
Molecular Weight253.31 g/mol
Exact Mass253.12
IUPAC Name4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol
SMILESNCc1cccn2c(Cc3ccc(O)cc3)ncc12
InChIInChI=1S/C15H15N3O/c16-9-12-2-1-7-18-14(12)10-17-15(18)8-11-3-5-13(19)6-4-11/h1-7,10,19H,8-9,16H2
InChIKeyFSYPDQDNAKPPSA-UHFFFAOYSA-N
XLogP2.09
TPSA63.55 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol?
The IUPAC name of 4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol (CID 117145848) is 4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol.
What is the SMILES notation for 4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol?
The canonical SMILES for 4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol is NCc1cccn2c(Cc3ccc(O)cc3)ncc12.
What is the InChIKey of 4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol?
The InChIKey is FSYPDQDNAKPPSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O/c16-9-12-2-1-7-18-14(12)10-17-15(18)8-11-3-5-13(19)6-4-11/h1-7,10,19H,8-9,16H2.
What are the key properties of 4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol?
4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol has a molecular weight of 253.31 g/mol, XLogP of 2.09, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[8-(aminomethyl)imidazo[1,5-a]pyridin-3-yl]methyl]phenol is sourced from PubChem (CID 117145848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).