3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid

C14H12N2O3 — CID 142717474

IUPAC3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid
SMILESNC(CC(=O)O)c1cc2cnc3ccccc3c2o1
InChIInChI=1S/C14H12N2O3/c15-10(6-13(17)18)12-5-8-7-16-11-4-2-1-3-9(11)14(8)19-12/h1-5,7,10H,6,15H2,(H,17,18)
InChIKeyIFAWTHOGBALABG-UHFFFAOYSA-N
MW256.26 g/mol
LogP2.46
Rot. Bonds3

About 3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid

3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid (PubChem CID 142717474) has the molecular formula C14H12N2O3 and a molecular weight of 256.26 g/mol. Its IUPAC name is 3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid.

Molecular Properties

Compound Name3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid
PubChem CID142717474
Molecular FormulaC14H12N2O3
Molecular Weight256.26 g/mol
Exact Mass256.08
IUPAC Name3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid
SMILESNC(CC(=O)O)c1cc2cnc3ccccc3c2o1
InChIInChI=1S/C14H12N2O3/c15-10(6-13(17)18)12-5-8-7-16-11-4-2-1-3-9(11)14(8)19-12/h1-5,7,10H,6,15H2,(H,17,18)
InChIKeyIFAWTHOGBALABG-UHFFFAOYSA-N
XLogP2.46
TPSA89.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.26
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

benzyl (Z)-3-amino-3-furo[3,2-c]quinolin-2-ylprop-2-enoate
CID 142717448
2-furo[3,2-c]quinolin-2-ylbenzamide
CID 142717445
(E)-3-furo[3,2-c]quinolin-2-yl-3-phenylprop-2-enoic acid
CID 142717452
3-amino-3-(4-fluoronaphthalen-1-yl)propanoic acid;hydrochloride
CID 91844833
2-[(5-phenyltetrazol-2-yl)methyl]furo[3,2-c]quinoline
CID 142717491
3-[(2-aminoacetyl)amino]-3-quinolin-3-ylpropanoic acid
CID 70246115
(3S)-3-amino-3-(4,5-dimethylfuran-2-yl)propanoic acid
CID 130699855
3-amino-3-(6-phenyl-3-pyridinyl)propanoic acid
CID 156612944
[2-amino-2-(3-aminoquinolin-4-yl)ethyl]carbamic acid
CID 57026745
(3S)-3-amino-3-(2-methylquinolin-4-yl)propanamide
CID 79237707
3-amino-3-([1,3]oxazolo[4,5-b]pyridin-2-yl)propanoic acid
CID 116990309
3-amino-4-(1,3-benzoxazol-2-yl)-4-hydroxybutanoic acid
CID 66853727

Frequently Asked Questions

What is the IUPAC name of 3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid?
The IUPAC name of 3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid (CID 142717474) is 3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid.
What is the SMILES notation for 3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid?
The canonical SMILES for 3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid is NC(CC(=O)O)c1cc2cnc3ccccc3c2o1.
What is the InChIKey of 3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid?
The InChIKey is IFAWTHOGBALABG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O3/c15-10(6-13(17)18)12-5-8-7-16-11-4-2-1-3-9(11)14(8)19-12/h1-5,7,10H,6,15H2,(H,17,18).
What are the key properties of 3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid?
3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid has a molecular weight of 256.26 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-furo[3,2-c]quinolin-2-ylpropanoic acid is sourced from PubChem (CID 142717474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).