1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine

C17H26FN — CID 65424379

IUPAC1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
SMILESCNC(c1ccccc1F)C1CCC(C(C)C)CC1
InChIInChI=1S/C17H26FN/c1-12(2)13-8-10-14(11-9-13)17(19-3)15-6-4-5-7-16(15)18/h4-7,12-14,17,19H,8-11H2,1-3H3
InChIKeyKEFMXQRXARRZIH-UHFFFAOYSA-N
MW263.40 g/mol
LogP4.55
Rot. Bonds4

About 1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine

1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine (PubChem CID 65424379) has the molecular formula C17H26FN and a molecular weight of 263.40 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
PubChem CID65424379
Molecular FormulaC17H26FN
Molecular Weight263.40 g/mol
Exact Mass263.20
IUPAC Name1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
SMILESCNC(c1ccccc1F)C1CCC(C(C)C)CC1
InChIInChI=1S/C17H26FN/c1-12(2)13-8-10-14(11-9-13)17(19-3)15-6-4-5-7-16(15)18/h4-7,12-14,17,19H,8-11H2,1-3H3
InChIKeyKEFMXQRXARRZIH-UHFFFAOYSA-N
XLogP4.55
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.40
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-tert-butylcyclohexyl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 65400352
4-[(2-fluorophenyl)-(methylamino)methyl]cyclohexan-1-one
CID 116957100
4-[(2-fluorophenyl)-(methylamino)methyl]cyclohexane-1-carboxylic acid
CID 116953971
1-(2-fluoro-4-methoxyphenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 103395598
1-cyclopropyl-N-methyl-1-(2-methylphenyl)methanamine
CID 60819765
1-(2,2-dimethylcyclopropyl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 107004239
1-(1-cyclopropylethyl)-2-fluorobenzene
CID 126566249
1-cyclopropyl-1-(2-fluoro-5-methylphenyl)-N-methylmethanamine
CID 62791210
(2S)-2-[[cyclopropyl-(2-fluorophenyl)methyl]amino]-3-methylbutan-1-ol
CID 69458844
1-(3,4-dihydro-2H-chromen-3-yl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 65411667
1-(2,5-dichlorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine
CID 65424192
1-(4,4-difluorocyclohexyl)-1-(2,6-difluorophenyl)-N-methylmethanamine
CID 105149449

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine?
The IUPAC name of 1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine (CID 65424379) is 1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine.
What is the SMILES notation for 1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine?
The canonical SMILES for 1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine is CNC(c1ccccc1F)C1CCC(C(C)C)CC1.
What is the InChIKey of 1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine?
The InChIKey is KEFMXQRXARRZIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26FN/c1-12(2)13-8-10-14(11-9-13)17(19-3)15-6-4-5-7-16(15)18/h4-7,12-14,17,19H,8-11H2,1-3H3.
What are the key properties of 1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine?
1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine has a molecular weight of 263.40 g/mol, XLogP of 4.55, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)methanamine is sourced from PubChem (CID 65424379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).