fluoromethane;N-propan-2-ylhexan-1-amine

C10H24FN — CID 171626710

IUPACfluoromethane;N-propan-2-ylhexan-1-amine
SMILESCCCCCCNC(C)C.CF
InChIInChI=1S/C9H21N.CH3F/c1-4-5-6-7-8-10-9(2)3;1-2/h9-10H,4-8H2,1-3H3;1H3
InChIKeyXYHIIMPSOZCHIV-UHFFFAOYSA-N
MW177.31 g/mol
LogP3.15
Rot. Bonds6

About fluoromethane;N-propan-2-ylhexan-1-amine

fluoromethane;N-propan-2-ylhexan-1-amine (PubChem CID 171626710) has the molecular formula C10H24FN and a molecular weight of 177.31 g/mol. Its IUPAC name is fluoromethane;N-propan-2-ylhexan-1-amine.

Molecular Properties

Compound Namefluoromethane;N-propan-2-ylhexan-1-amine
PubChem CID171626710
Molecular FormulaC10H24FN
Molecular Weight177.31 g/mol
Exact Mass177.19
IUPAC Namefluoromethane;N-propan-2-ylhexan-1-amine
SMILESCCCCCCNC(C)C.CF
InChIInChI=1S/C9H21N.CH3F/c1-4-5-6-7-8-10-9(2)3;1-2/h9-10H,4-8H2,1-3H3;1H3
InChIKeyXYHIIMPSOZCHIV-UHFFFAOYSA-N
XLogP3.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.31
LogP ≤ 53.15
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

N-propan-2-ylicosan-1-amine
CID 87246132
N-propan-2-ylnonan-1-amine;hydrochloride
CID 172836169
molecular hydrogen;N-propan-2-ylnonan-1-amine
CID 166461486
N-propan-2-ylbutan-1-amine chloride
CID 19629099
4-pentoxy-N-propan-2-ylbutan-1-amine
CID 62449715
N-octyloctan-1-amine;5-(propan-2-ylamino)pentan-1-ol
CID 21412290
octadecanoic acid;N-propan-2-ylpentadecan-1-amine
CID 174971030
N-(1,1-difluoropropan-2-yl)octan-1-amine
CID 102869921
N-(1,1-difluoropropan-2-yl)hexan-1-amine
CID 102868054
N-(3-methylbutan-2-yl)heptan-1-amine
CID 43131205
(1S)-1-(hexylamino)ethanethiol
CID 142113099
N-butan-2-yldodecan-1-amine
CID 63489622

Frequently Asked Questions

What is the IUPAC name of fluoromethane;N-propan-2-ylhexan-1-amine?
The IUPAC name of fluoromethane;N-propan-2-ylhexan-1-amine (CID 171626710) is fluoromethane;N-propan-2-ylhexan-1-amine.
What is the SMILES notation for fluoromethane;N-propan-2-ylhexan-1-amine?
The canonical SMILES for fluoromethane;N-propan-2-ylhexan-1-amine is CCCCCCNC(C)C.CF.
What is the InChIKey of fluoromethane;N-propan-2-ylhexan-1-amine?
The InChIKey is XYHIIMPSOZCHIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N.CH3F/c1-4-5-6-7-8-10-9(2)3;1-2/h9-10H,4-8H2,1-3H3;1H3.
What are the key properties of fluoromethane;N-propan-2-ylhexan-1-amine?
fluoromethane;N-propan-2-ylhexan-1-amine has a molecular weight of 177.31 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for fluoromethane;N-propan-2-ylhexan-1-amine is sourced from PubChem (CID 171626710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).