N-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine

C10H22FNO — CID 143945290

IUPACN-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine
SMILESCOCC(C)(C)CNCC(C)(C)F
InChIInChI=1S/C10H22FNO/c1-9(2,8-13-5)6-12-7-10(3,4)11/h12H,6-8H2,1-5H3
InChIKeySLPPYMLENQCMRJ-UHFFFAOYSA-N
MW191.29 g/mol
LogP2.00
Rot. Bonds6

About N-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine

N-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine (PubChem CID 143945290) has the molecular formula C10H22FNO and a molecular weight of 191.29 g/mol. Its IUPAC name is N-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine
PubChem CID143945290
Molecular FormulaC10H22FNO
Molecular Weight191.29 g/mol
Exact Mass191.17
IUPAC NameN-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine
SMILESCOCC(C)(C)CNCC(C)(C)F
InChIInChI=1S/C10H22FNO/c1-9(2,8-13-5)6-12-7-10(3,4)11/h12H,6-8H2,1-5H3
InChIKeySLPPYMLENQCMRJ-UHFFFAOYSA-N
XLogP2.00
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.29
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,2-difluoroethyl)-2,2-dimethyl-3-propan-2-yloxypropan-1-amine
CID 58303694
2,2-dimethyl-3-propan-2-yloxy-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 58303698
N-(2,2-difluoroethyl)-3-methoxy-2,2-dimethylpropan-1-amine
CID 88936095
3-methoxy-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 88936096
3-ethoxy-2,2-dimethyl-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 89840445
N-(fluoromethyl)-1-(3-methyloxetan-3-yl)methanamine
CID 134447413
N-ethyl-2-fluoro-2-methyl-3-propan-2-yloxypropan-1-amine
CID 135175069
N-(3-butoxy-2-fluoropropyl)-2-methylpropan-2-amine
CID 161286342
N-[(3-fluorooxetan-3-yl)methyl]-2,2-dimethylpropan-1-amine
CID 177265532
2,2-dimethyl-N-[3-(2,2,2-trifluoroethoxy)propyl]propan-1-amine
CID 61491307
3,3,3-trifluoro-N-[(3-methyloxetan-3-yl)methyl]propan-1-amine
CID 64372839
3-methoxy-2-methyl-N-(3,3,3-trifluoropropyl)propan-1-amine
CID 64555007

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine?
The IUPAC name of N-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine (CID 143945290) is N-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine.
What is the SMILES notation for N-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine?
The canonical SMILES for N-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine is COCC(C)(C)CNCC(C)(C)F.
What is the InChIKey of N-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine?
The InChIKey is SLPPYMLENQCMRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22FNO/c1-9(2,8-13-5)6-12-7-10(3,4)11/h12H,6-8H2,1-5H3.
What are the key properties of N-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine?
N-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine has a molecular weight of 191.29 g/mol, XLogP of 2.00, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-2-methylpropyl)-3-methoxy-2,2-dimethylpropan-1-amine is sourced from PubChem (CID 143945290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).