2-amino-4-morpholin-4-ylquinoline-3-carbonitrile

C14H14N4O — CID 10610954

IUPAC2-amino-4-morpholin-4-ylquinoline-3-carbonitrile
SMILESN#Cc1c(N)nc2ccccc2c1N1CCOCC1
InChIInChI=1S/C14H14N4O/c15-9-11-13(18-5-7-19-8-6-18)10-3-1-2-4-12(10)17-14(11)16/h1-4H,5-8H2,(H2,16,17)
InChIKeyAUCJJRBKZJSBFH-UHFFFAOYSA-N
MW254.29 g/mol
LogP1.53
Rot. Bonds1

About 2-amino-4-morpholin-4-ylquinoline-3-carbonitrile

2-amino-4-morpholin-4-ylquinoline-3-carbonitrile (PubChem CID 10610954) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 2-amino-4-morpholin-4-ylquinoline-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-morpholin-4-ylquinoline-3-carbonitrile
PubChem CID10610954
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name2-amino-4-morpholin-4-ylquinoline-3-carbonitrile
SMILESN#Cc1c(N)nc2ccccc2c1N1CCOCC1
InChIInChI=1S/C14H14N4O/c15-9-11-13(18-5-7-19-8-6-18)10-3-1-2-4-12(10)17-14(11)16/h1-4H,5-8H2,(H2,16,17)
InChIKeyAUCJJRBKZJSBFH-UHFFFAOYSA-N
XLogP1.53
TPSA75.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-morpholin-4-ylquinoline-3-carbonitrile?
The IUPAC name of 2-amino-4-morpholin-4-ylquinoline-3-carbonitrile (CID 10610954) is 2-amino-4-morpholin-4-ylquinoline-3-carbonitrile.
What is the SMILES notation for 2-amino-4-morpholin-4-ylquinoline-3-carbonitrile?
The canonical SMILES for 2-amino-4-morpholin-4-ylquinoline-3-carbonitrile is N#Cc1c(N)nc2ccccc2c1N1CCOCC1.
What is the InChIKey of 2-amino-4-morpholin-4-ylquinoline-3-carbonitrile?
The InChIKey is AUCJJRBKZJSBFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c15-9-11-13(18-5-7-19-8-6-18)10-3-1-2-4-12(10)17-14(11)16/h1-4H,5-8H2,(H2,16,17).
What are the key properties of 2-amino-4-morpholin-4-ylquinoline-3-carbonitrile?
2-amino-4-morpholin-4-ylquinoline-3-carbonitrile has a molecular weight of 254.29 g/mol, XLogP of 1.53, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-morpholin-4-ylquinoline-3-carbonitrile is sourced from PubChem (CID 10610954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).