2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine

C7H13F2N — CID 176814532

IUPAC2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine
SMILESCC(C)N(C)C1CC1(F)F
InChIInChI=1S/C7H13F2N/c1-5(2)10(3)6-4-7(6,8)9/h5-6H,4H2,1-3H3
InChIKeyFLJBAENDEDQIMI-UHFFFAOYSA-N
MW149.18 g/mol
LogP1.73
Rot. Bonds2

About 2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine

2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine (PubChem CID 176814532) has the molecular formula C7H13F2N and a molecular weight of 149.18 g/mol. Its IUPAC name is 2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine.

Molecular Properties

Compound Name2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine
PubChem CID176814532
Molecular FormulaC7H13F2N
Molecular Weight149.18 g/mol
Exact Mass149.10
IUPAC Name2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine
SMILESCC(C)N(C)C1CC1(F)F
InChIInChI=1S/C7H13F2N/c1-5(2)10(3)6-4-7(6,8)9/h5-6H,4H2,1-3H3
InChIKeyFLJBAENDEDQIMI-UHFFFAOYSA-N
XLogP1.73
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.18
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-methyl-N-propan-2-ylcyclopropanamine
CID 21024125
trans-(2R,3R)-2,3-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine
CID 172508216
trans-(1R,2R)-N,2-dimethyl-N-propan-2-ylcyclopropan-1-amine
CID 172508156
2,2,5,5-tetrafluoro-1,3,3a,4,6,6a-hexahydropentalene
CID 139551105
1-[(1S,2R)-2-amino-3,3-difluorocyclohexyl]-N-methyl-N-propan-2-ylpiperidin-4-amine
CID 156746068
N-(3,3-difluorocyclobutyl)-N-methylthiohydroxylamine
CID 123880824
N,2,2-trimethyl-N-propan-2-ylpiperidin-4-amine
CID 115145402
ethane;N-methyl-N-propan-2-ylcyclohexanamine;propane
CID 142239228
N-[(2,2-difluorocyclopropyl)methyl]-3,3-difluoro-N-methylcyclobutan-1-amine;hydrochloride
CID 166258945
trans-(1S,2S)-2-[methyl(propan-2-yl)amino]cyclopentan-1-ol
CID 93346502
N,N-dimethylpropan-2-amine;ethane
CID 143195472
(4R)-3,3-difluoro-N-methyl-N-[(1R)-1-phenylethyl]piperidin-4-amine
CID 154669081

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine?
The IUPAC name of 2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine (CID 176814532) is 2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine.
What is the SMILES notation for 2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine?
The canonical SMILES for 2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine is CC(C)N(C)C1CC1(F)F.
What is the InChIKey of 2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine?
The InChIKey is FLJBAENDEDQIMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13F2N/c1-5(2)10(3)6-4-7(6,8)9/h5-6H,4H2,1-3H3.
What are the key properties of 2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine?
2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine has a molecular weight of 149.18 g/mol, XLogP of 1.73, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-methyl-N-propan-2-ylcyclopropan-1-amine is sourced from PubChem (CID 176814532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).