N-[(2,5-difluorophenyl)methyl]quinolin-6-amine

C16H12F2N2 — CID 62634585

IUPACN-[(2,5-difluorophenyl)methyl]quinolin-6-amine
SMILESFc1ccc(F)c(CNc2ccc3ncccc3c2)c1
InChIInChI=1S/C16H12F2N2/c17-13-3-5-15(18)12(8-13)10-20-14-4-6-16-11(9-14)2-1-7-19-16/h1-9,20H,10H2
InChIKeyDWQOAWKHNSLQFO-UHFFFAOYSA-N
MW270.28 g/mol
LogP4.13
Rot. Bonds3

About N-[(2,5-difluorophenyl)methyl]quinolin-6-amine

N-[(2,5-difluorophenyl)methyl]quinolin-6-amine (PubChem CID 62634585) has the molecular formula C16H12F2N2 and a molecular weight of 270.28 g/mol. Its IUPAC name is N-[(2,5-difluorophenyl)methyl]quinolin-6-amine.

Molecular Properties

Compound NameN-[(2,5-difluorophenyl)methyl]quinolin-6-amine
PubChem CID62634585
Molecular FormulaC16H12F2N2
Molecular Weight270.28 g/mol
Exact Mass270.10
IUPAC NameN-[(2,5-difluorophenyl)methyl]quinolin-6-amine
SMILESFc1ccc(F)c(CNc2ccc3ncccc3c2)c1
InChIInChI=1S/C16H12F2N2/c17-13-3-5-15(18)12(8-13)10-20-14-4-6-16-11(9-14)2-1-7-19-16/h1-9,20H,10H2
InChIKeyDWQOAWKHNSLQFO-UHFFFAOYSA-N
XLogP4.13
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.28
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,6-difluoro-4-[(quinolin-6-ylamino)methyl]phenol
CID 79883860
N-[(2-chloro-6-fluorophenyl)methyl]quinolin-6-amine
CID 62636135
4-N-[(2,5-difluorophenyl)methyl]pyridine-2,4-diamine
CID 113367849
N-[(3,4-dimethylphenyl)methyl]quinolin-6-amine
CID 62634241
4-chloro-3-fluoro-N-(quinolin-6-ylmethyl)aniline
CID 61470243
N-[1-(2,5-difluorophenyl)ethyl]quinolin-6-amine
CID 62634757
2-N-[(2,5-difluorophenyl)methyl]pyridine-2,3-diamine
CID 63795498
N-(pyridin-3-ylmethyl)quinolin-6-amine
CID 53392291
N-(1-benzofuran-3-ylmethyl)quinolin-6-amine
CID 80700880
N-(1H-indol-3-ylmethyl)quinolin-6-amine
CID 62635279
N-(3,3-dimethylbutyl)quinolin-6-amine
CID 62950963
4-N-[(2,5-difluorophenyl)methyl]-2-fluorobenzene-1,4-diamine
CID 115123866

Frequently Asked Questions

What is the IUPAC name of N-[(2,5-difluorophenyl)methyl]quinolin-6-amine?
The IUPAC name of N-[(2,5-difluorophenyl)methyl]quinolin-6-amine (CID 62634585) is N-[(2,5-difluorophenyl)methyl]quinolin-6-amine.
What is the SMILES notation for N-[(2,5-difluorophenyl)methyl]quinolin-6-amine?
The canonical SMILES for N-[(2,5-difluorophenyl)methyl]quinolin-6-amine is Fc1ccc(F)c(CNc2ccc3ncccc3c2)c1.
What is the InChIKey of N-[(2,5-difluorophenyl)methyl]quinolin-6-amine?
The InChIKey is DWQOAWKHNSLQFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12F2N2/c17-13-3-5-15(18)12(8-13)10-20-14-4-6-16-11(9-14)2-1-7-19-16/h1-9,20H,10H2.
What are the key properties of N-[(2,5-difluorophenyl)methyl]quinolin-6-amine?
N-[(2,5-difluorophenyl)methyl]quinolin-6-amine has a molecular weight of 270.28 g/mol, XLogP of 4.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,5-difluorophenyl)methyl]quinolin-6-amine is sourced from PubChem (CID 62634585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).