N-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide

C20H15N3O2 — CID 112989291

IUPACN-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(Nc2cccc3cccnc23)cc1)c1ccco1
InChIInChI=1S/C20H15N3O2/c24-20(18-7-3-13-25-18)23-16-10-8-15(9-11-16)22-17-6-1-4-14-5-2-12-21-19(14)17/h1-13,22H,(H,23,24)
InChIKeyPBTXCAWHTNBCNS-UHFFFAOYSA-N
MW329.36 g/mol
LogP4.82
Rot. Bonds4

About N-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide

N-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide (PubChem CID 112989291) has the molecular formula C20H15N3O2 and a molecular weight of 329.36 g/mol. Its IUPAC name is N-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide
PubChem CID112989291
Molecular FormulaC20H15N3O2
Molecular Weight329.36 g/mol
Exact Mass329.12
IUPAC NameN-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(Nc2cccc3cccnc23)cc1)c1ccco1
InChIInChI=1S/C20H15N3O2/c24-20(18-7-3-13-25-18)23-16-10-8-15(9-11-16)22-17-6-1-4-14-5-2-12-21-19(14)17/h1-13,22H,(H,23,24)
InChIKeyPBTXCAWHTNBCNS-UHFFFAOYSA-N
XLogP4.82
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 54.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(quinolin-8-ylamino)-3-pyridinyl]furan-2-carboxamide
CID 113021727
N-[4-(quinolin-8-ylamino)phenyl]pyridine-3-carboxamide
CID 112989314
methyl N-[4-(quinolin-8-ylamino)phenyl]carbamate
CID 112989327
N-[4-(furan-2-carbonylamino)phenyl]furan-2-carboxamide
CID 565232
N-(6-chloroquinolin-8-yl)furan-2-carboxamide
CID 60729929
3-methyl-N-[4-(quinolin-8-ylamino)phenyl]butanamide
CID 112989286
2-(4-methoxyphenyl)-N-[4-(quinolin-8-ylamino)phenyl]acetamide
CID 112989310
N-[4-(dimethylamino)phenyl]-5-(quinolin-8-ylamino)pyridine-2-carboxamide
CID 109200554
N-[4-(methylamino)phenyl]furan-2-carboxamide
CID 63091259
[4-(furan-2-carbonylamino)phenyl]carbamic acid
CID 18543126
3-methyl-N-quinolin-8-ylfuran-2-carboxamide
CID 17461248
N-(furan-2-ylmethyl)-5-(quinolin-8-ylamino)pyridine-3-carboxamide
CID 109231433

Frequently Asked Questions

What is the IUPAC name of N-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide?
The IUPAC name of N-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide (CID 112989291) is N-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide?
The canonical SMILES for N-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide is O=C(Nc1ccc(Nc2cccc3cccnc23)cc1)c1ccco1.
What is the InChIKey of N-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide?
The InChIKey is PBTXCAWHTNBCNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O2/c24-20(18-7-3-13-25-18)23-16-10-8-15(9-11-16)22-17-6-1-4-14-5-2-12-21-19(14)17/h1-13,22H,(H,23,24).
What are the key properties of N-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide?
N-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide has a molecular weight of 329.36 g/mol, XLogP of 4.82, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(quinolin-8-ylamino)phenyl]furan-2-carboxamide is sourced from PubChem (CID 112989291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).