1-(quinolin-4-ylamino)pentan-2-ol

C14H18N2O — CID 113234733

IUPAC1-(quinolin-4-ylamino)pentan-2-ol
SMILESCCCC(O)CNc1ccnc2ccccc12
InChIInChI=1S/C14H18N2O/c1-2-5-11(17)10-16-14-8-9-15-13-7-4-3-6-12(13)14/h3-4,6-9,11,17H,2,5,10H2,1H3,(H,15,16)
InChIKeyAUWXEGSBLLRIHF-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.81
Rot. Bonds5

About 1-(quinolin-4-ylamino)pentan-2-ol

1-(quinolin-4-ylamino)pentan-2-ol (PubChem CID 113234733) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-(quinolin-4-ylamino)pentan-2-ol.

Molecular Properties

Compound Name1-(quinolin-4-ylamino)pentan-2-ol
PubChem CID113234733
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name1-(quinolin-4-ylamino)pentan-2-ol
SMILESCCCC(O)CNc1ccnc2ccccc12
InChIInChI=1S/C14H18N2O/c1-2-5-11(17)10-16-14-8-9-15-13-7-4-3-6-12(13)14/h3-4,6-9,11,17H,2,5,10H2,1H3,(H,15,16)
InChIKeyAUWXEGSBLLRIHF-UHFFFAOYSA-N
XLogP2.81
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(quinolin-4-ylamino)pentan-2-ol?
The IUPAC name of 1-(quinolin-4-ylamino)pentan-2-ol (CID 113234733) is 1-(quinolin-4-ylamino)pentan-2-ol.
What is the SMILES notation for 1-(quinolin-4-ylamino)pentan-2-ol?
The canonical SMILES for 1-(quinolin-4-ylamino)pentan-2-ol is CCCC(O)CNc1ccnc2ccccc12.
What is the InChIKey of 1-(quinolin-4-ylamino)pentan-2-ol?
The InChIKey is AUWXEGSBLLRIHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-2-5-11(17)10-16-14-8-9-15-13-7-4-3-6-12(13)14/h3-4,6-9,11,17H,2,5,10H2,1H3,(H,15,16).
What are the key properties of 1-(quinolin-4-ylamino)pentan-2-ol?
1-(quinolin-4-ylamino)pentan-2-ol has a molecular weight of 230.31 g/mol, XLogP of 2.81, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(quinolin-4-ylamino)pentan-2-ol is sourced from PubChem (CID 113234733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).