N-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide

C26H19N5O2 — CID 90843396

IUPACN-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide
SMILESCc1cc(C(=O)N[C@@H]2c3ccccc3-c3c(-c4nc5ccncc5[nH]4)cccc32)cc(=O)[nH]1
InChIInChI=1S/C26H19N5O2/c1-14-11-15(12-22(32)28-14)26(33)31-24-17-6-3-2-5-16(17)23-18(24)7-4-8-19(23)25-29-20-9-10-27-13-21(20)30-25/h2-13,24H,1H3,(H,28,32)(H,29,30)(H,31,33)/t24-/m1/s1
InChIKeyOXZOCOGXNDHVMY-XMMPIXPASA-N
MW433.47 g/mol
LogP4.12
Rot. Bonds3

About N-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide

N-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide (PubChem CID 90843396) has the molecular formula C26H19N5O2 and a molecular weight of 433.47 g/mol. Its IUPAC name is N-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide
PubChem CID90843396
Molecular FormulaC26H19N5O2
Molecular Weight433.47 g/mol
Exact Mass433.15
IUPAC NameN-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide
SMILESCc1cc(C(=O)N[C@@H]2c3ccccc3-c3c(-c4nc5ccncc5[nH]4)cccc32)cc(=O)[nH]1
InChIInChI=1S/C26H19N5O2/c1-14-11-15(12-22(32)28-14)26(33)31-24-17-6-3-2-5-16(17)23-18(24)7-4-8-19(23)25-29-20-9-10-27-13-21(20)30-25/h2-13,24H,1H3,(H,28,32)(H,29,30)(H,31,33)/t24-/m1/s1
InChIKeyOXZOCOGXNDHVMY-XMMPIXPASA-N
XLogP4.12
TPSA103.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms33
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.47
LogP ≤ 54.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The IUPAC name of N-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide (CID 90843396) is N-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide.
What is the SMILES notation for N-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The canonical SMILES for N-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide is Cc1cc(C(=O)N[C@@H]2c3ccccc3-c3c(-c4nc5ccncc5[nH]4)cccc32)cc(=O)[nH]1.
What is the InChIKey of N-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
The InChIKey is OXZOCOGXNDHVMY-XMMPIXPASA-N. The full InChI is InChI=1S/C26H19N5O2/c1-14-11-15(12-22(32)28-14)26(33)31-24-17-6-3-2-5-16(17)23-18(24)7-4-8-19(23)25-29-20-9-10-27-13-21(20)30-25/h2-13,24H,1H3,(H,28,32)(H,29,30)(H,31,33)/t24-/m1/s1.
What are the key properties of N-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide?
N-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide has a molecular weight of 433.47 g/mol, XLogP of 4.12, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(9R)-4-(3H-imidazo[4,5-c]pyridin-2-yl)-9H-fluoren-9-yl]-2-methyl-6-oxo-1H-pyridine-4-carboxamide is sourced from PubChem (CID 90843396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).