1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine

C20H26FN3 — CID 67214444

IUPAC1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine
SMILESFc1ccc(-c2cnc(C(NCC3CC3)C3CCCCC3)[nH]2)cc1
InChIInChI=1S/C20H26FN3/c21-17-10-8-15(9-11-17)18-13-23-20(24-18)19(22-12-14-6-7-14)16-4-2-1-3-5-16/h8-11,13-14,16,19,22H,1-7,12H2,(H,23,24)
InChIKeyJYBWBVUBFXDDGD-UHFFFAOYSA-N
MW327.45 g/mol
LogP4.84
Rot. Bonds6

About 1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine

1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine (PubChem CID 67214444) has the molecular formula C20H26FN3 and a molecular weight of 327.45 g/mol. Its IUPAC name is 1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine.

Molecular Properties

Compound Name1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine
PubChem CID67214444
Molecular FormulaC20H26FN3
Molecular Weight327.45 g/mol
Exact Mass327.21
IUPAC Name1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine
SMILESFc1ccc(-c2cnc(C(NCC3CC3)C3CCCCC3)[nH]2)cc1
InChIInChI=1S/C20H26FN3/c21-17-10-8-15(9-11-17)18-13-23-20(24-18)19(22-12-14-6-7-14)16-4-2-1-3-5-16/h8-11,13-14,16,19,22H,1-7,12H2,(H,23,24)
InChIKeyJYBWBVUBFXDDGD-UHFFFAOYSA-N
XLogP4.84
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.45
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine
CID 67214443
(1R)-2-cyclohexyl-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]ethanamine
CID 67214244
(S)-cyclopropyl-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine
CID 67214433
4-[2-[(S)-cyclohexyl-(cyclohexylamino)methyl]-1H-imidazol-5-yl]-N,N-diethylaniline
CID 67214282
1-cyclopropyl-N-(cyclopropylmethyl)-1-(4-fluorophenyl)methanamine
CID 43756811
cyclohexyl-[5-(3-fluoro-4-methoxyphenyl)-1H-imidazol-2-yl]methanamine
CID 67214797
1-cyclobutyl-1-(4-fluorophenyl)-N-(piperidin-4-ylmethyl)methanamine
CID 119932506
N-(cyclobutylmethyl)-1-[5-(3,5-dimethylphenyl)-1H-imidazol-2-yl]ethanamine
CID 102970600
N-[7-[5-(4-fluorophenyl)-1H-imidazol-2-yl]heptyl]cyclobutanamine
CID 70074424
1-cyclohexyl-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]ethanamine
CID 102970675
cyclohexyl-[(1S)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]-2,2-dimethylpropyl]carbamic acid
CID 67214295
2-cyclopropyl-5-(4-fluorophenyl)-1H-imidazole
CID 90241425

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine?
The IUPAC name of 1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine (CID 67214444) is 1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine.
What is the SMILES notation for 1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine?
The canonical SMILES for 1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine is Fc1ccc(-c2cnc(C(NCC3CC3)C3CCCCC3)[nH]2)cc1.
What is the InChIKey of 1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine?
The InChIKey is JYBWBVUBFXDDGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26FN3/c21-17-10-8-15(9-11-17)18-13-23-20(24-18)19(22-12-14-6-7-14)16-4-2-1-3-5-16/h8-11,13-14,16,19,22H,1-7,12H2,(H,23,24).
What are the key properties of 1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine?
1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine has a molecular weight of 327.45 g/mol, XLogP of 4.84, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-(cyclopropylmethyl)-1-[5-(4-fluorophenyl)-1H-imidazol-2-yl]methanamine is sourced from PubChem (CID 67214444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).