1-(2-fluorophenyl)-2-methyldecan-2-amine

C17H28FN — CID 114833515

IUPAC1-(2-fluorophenyl)-2-methyldecan-2-amine
SMILESCCCCCCCCC(C)(N)Cc1ccccc1F
InChIInChI=1S/C17H28FN/c1-3-4-5-6-7-10-13-17(2,19)14-15-11-8-9-12-16(15)18/h8-9,11-12H,3-7,10,13-14,19H2,1-2H3
InChIKeyLWODNBMHFYVPCG-UHFFFAOYSA-N
MW265.42 g/mol
LogP4.84
Rot. Bonds9

About 1-(2-fluorophenyl)-2-methyldecan-2-amine

1-(2-fluorophenyl)-2-methyldecan-2-amine (PubChem CID 114833515) has the molecular formula C17H28FN and a molecular weight of 265.42 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-2-methyldecan-2-amine.

Molecular Properties

Compound Name1-(2-fluorophenyl)-2-methyldecan-2-amine
PubChem CID114833515
Molecular FormulaC17H28FN
Molecular Weight265.42 g/mol
Exact Mass265.22
IUPAC Name1-(2-fluorophenyl)-2-methyldecan-2-amine
SMILESCCCCCCCCC(C)(N)Cc1ccccc1F
InChIInChI=1S/C17H28FN/c1-3-4-5-6-7-10-13-17(2,19)14-15-11-8-9-12-16(15)18/h8-9,11-12H,3-7,10,13-14,19H2,1-2H3
InChIKeyLWODNBMHFYVPCG-UHFFFAOYSA-N
XLogP4.84
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.42
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(2-fluorophenyl)-2-methyloctan-2-amine
CID 114833613
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1-(2-fluorophenyl)-2-methylpropan-2-amine;hydrochloride
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1-fluoro-2-heptylbenzene
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2-N-[(2-fluorophenyl)methyl]-2-N,2-dimethylnonane-1,2-diamine
CID 63470423
1-(2,3-difluorophenyl)-2-methylheptan-2-ol
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1-fluoro-2-(2-methyloctan-2-yl)benzene
CID 155122993
1-(2-chloro-3-fluorophenyl)-2-methylheptan-2-ol
CID 112653134
1,1-diphenyldodecan-1-amine
CID 19925745
2-(2-fluorophenyl)nonan-2-ol
CID 65144891
3-(2-fluorophenyl)-2,2-dimethylpropan-1-amine
CID 62739574
N-tert-butyl-2-ethyl-2-[(2-fluorophenyl)methyl]hexan-1-amine
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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-2-methyldecan-2-amine?
The IUPAC name of 1-(2-fluorophenyl)-2-methyldecan-2-amine (CID 114833515) is 1-(2-fluorophenyl)-2-methyldecan-2-amine.
What is the SMILES notation for 1-(2-fluorophenyl)-2-methyldecan-2-amine?
The canonical SMILES for 1-(2-fluorophenyl)-2-methyldecan-2-amine is CCCCCCCCC(C)(N)Cc1ccccc1F.
What is the InChIKey of 1-(2-fluorophenyl)-2-methyldecan-2-amine?
The InChIKey is LWODNBMHFYVPCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28FN/c1-3-4-5-6-7-10-13-17(2,19)14-15-11-8-9-12-16(15)18/h8-9,11-12H,3-7,10,13-14,19H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-2-methyldecan-2-amine?
1-(2-fluorophenyl)-2-methyldecan-2-amine has a molecular weight of 265.42 g/mol, XLogP of 4.84, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-2-methyldecan-2-amine is sourced from PubChem (CID 114833515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).