N-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine

C10H12FN3O — CID 114400318

IUPACN-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCOc1ccc(F)c(NC2=NCCN2)c1
InChIInChI=1S/C10H12FN3O/c1-15-7-2-3-8(11)9(6-7)14-10-12-4-5-13-10/h2-3,6H,4-5H2,1H3,(H2,12,13,14)
InChIKeyYHAMQDJPLSRULG-UHFFFAOYSA-N
MW209.22 g/mol
LogP1.21
Rot. Bonds2

About N-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine

N-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 114400318) has the molecular formula C10H12FN3O and a molecular weight of 209.22 g/mol. Its IUPAC name is N-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine
PubChem CID114400318
Molecular FormulaC10H12FN3O
Molecular Weight209.22 g/mol
Exact Mass209.10
IUPAC NameN-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine
SMILESCOc1ccc(F)c(NC2=NCCN2)c1
InChIInChI=1S/C10H12FN3O/c1-15-7-2-3-8(11)9(6-7)14-10-12-4-5-13-10/h2-3,6H,4-5H2,1H3,(H2,12,13,14)
InChIKeyYHAMQDJPLSRULG-UHFFFAOYSA-N
XLogP1.21
TPSA45.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.22
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-fluorophenyl)-4,5-dihydro-1H-imidazol-2-amine
CID 5242373
3-(2-fluoro-5-methoxyanilino)pyridazine-4-carbothioamide
CID 80511551
(2-fluoro-5-methoxyphenyl)hydrazine
CID 34175304
7-chloro-5-(2-fluoro-5-methoxyphenyl)-2,3-dihydro-1H-1,4-benzodiazepine
CID 175578723
2-(4,5-dihydro-1H-imidazol-2-yl)-3-fluoro-N-(4-methoxyphenyl)aniline
CID 82249804
2-fluoro-5-methoxy-N-(pyrrolidin-2-ylmethyl)aniline
CID 106638811
2-[(E)-(4,5-dihydro-1H-imidazol-2-ylhydrazinylidene)methyl]-4-methoxyphenol
CID 135636667
methyl 4-(4,5-dihydro-1H-imidazol-2-ylamino)-3-methylbenzoate
CID 12769659
5-bromo-6-chloro-N-(2-fluoro-5-methoxyphenyl)pyrimidin-4-amine
CID 114071767
5-ethyl-4-N-(2-fluoro-5-methoxyphenyl)-6-N-methylpyrimidine-4,6-diamine
CID 80854900
2-(4,5-dihydro-1H-imidazol-2-ylamino)-6-fluorobenzonitrile
CID 114400085
2-N-(2-fluoro-5-methoxyphenyl)pyrazine-2,6-diamine
CID 80647697

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine (CID 114400318) is N-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine is COc1ccc(F)c(NC2=NCCN2)c1.
What is the InChIKey of N-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is YHAMQDJPLSRULG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FN3O/c1-15-7-2-3-8(11)9(6-7)14-10-12-4-5-13-10/h2-3,6H,4-5H2,1H3,(H2,12,13,14).
What are the key properties of N-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine?
N-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 209.22 g/mol, XLogP of 1.21, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-methoxyphenyl)-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 114400318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).