1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine

C13H14FN3 — CID 106559126

IUPAC1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine
SMILESFc1ccccc1CNc1nccn1C1CC1
InChIInChI=1S/C13H14FN3/c14-12-4-2-1-3-10(12)9-16-13-15-7-8-17(13)11-5-6-11/h1-4,7-8,11H,5-6,9H2,(H,15,16)
InChIKeyRGAWHGLQIBCRRP-UHFFFAOYSA-N
MW231.27 g/mol
LogP2.97
Rot. Bonds4

About 1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine

1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine (PubChem CID 106559126) has the molecular formula C13H14FN3 and a molecular weight of 231.27 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine
PubChem CID106559126
Molecular FormulaC13H14FN3
Molecular Weight231.27 g/mol
Exact Mass231.12
IUPAC Name1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine
SMILESFc1ccccc1CNc1nccn1C1CC1
InChIInChI=1S/C13H14FN3/c14-12-4-2-1-3-10(12)9-16-13-15-7-8-17(13)11-5-6-11/h1-4,7-8,11H,5-6,9H2,(H,15,16)
InChIKeyRGAWHGLQIBCRRP-UHFFFAOYSA-N
XLogP2.97
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.27
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-1-cyclopropylimidazol-2-amine
CID 106555906
1-cyclohexyl-N-[(2-ethylphenyl)methyl]imidazol-2-amine
CID 106574558
N-[(2-fluorophenyl)methyl]-1-propylimidazol-2-amine
CID 106559103
1-cyclohexyl-N-[(4-fluorophenyl)methyl]imidazol-2-amine
CID 106558880
1-cyclohexyl-N-[(3,4-difluorophenyl)methyl]imidazol-2-amine
CID 106565229
1-cyclopropyl-N-[(2-methylpyrazol-3-yl)methyl]imidazol-2-amine
CID 106573717
N-[(3-chloro-4-fluorophenyl)methyl]-1-cyclohexylimidazol-2-amine
CID 106570228
1-cyclopropyl-N-propylimidazol-2-amine
CID 106554744
1-cyclopropyl-N-(2,6-diethylphenyl)imidazol-2-amine
CID 106556079
1-cyclohexyl-N-[(6-methyl-2-pyridinyl)methyl]imidazol-2-amine
CID 106569352
N-(7-bicyclo[4.2.0]octa-1,3,5-trienylmethyl)-1-cyclopropylimidazol-2-amine
CID 106575953
1-cyclopropyl-N-[2-(methoxymethyl)phenyl]imidazol-2-amine
CID 106568622

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine?
The IUPAC name of 1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine (CID 106559126) is 1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine.
What is the SMILES notation for 1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine?
The canonical SMILES for 1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine is Fc1ccccc1CNc1nccn1C1CC1.
What is the InChIKey of 1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine?
The InChIKey is RGAWHGLQIBCRRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FN3/c14-12-4-2-1-3-10(12)9-16-13-15-7-8-17(13)11-5-6-11/h1-4,7-8,11H,5-6,9H2,(H,15,16).
What are the key properties of 1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine?
1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine has a molecular weight of 231.27 g/mol, XLogP of 2.97, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(2-fluorophenyl)methyl]imidazol-2-amine is sourced from PubChem (CID 106559126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).