N-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine

C9H16F3N — CID 66615241

IUPACN-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine
SMILESCC(C)NC1(C(F)(F)F)CCCC1
InChIInChI=1S/C9H16F3N/c1-7(2)13-8(9(10,11)12)5-3-4-6-8/h7,13H,3-6H2,1-2H3
InChIKeyDTGFYMUWQNRALU-UHFFFAOYSA-N
MW195.23 g/mol
LogP2.86
Rot. Bonds2

About N-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine

N-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine (PubChem CID 66615241) has the molecular formula C9H16F3N and a molecular weight of 195.23 g/mol. Its IUPAC name is N-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine
PubChem CID66615241
Molecular FormulaC9H16F3N
Molecular Weight195.23 g/mol
Exact Mass195.12
IUPAC NameN-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine
SMILESCC(C)NC1(C(F)(F)F)CCCC1
InChIInChI=1S/C9H16F3N/c1-7(2)13-8(9(10,11)12)5-3-4-6-8/h7,13H,3-6H2,1-2H3
InChIKeyDTGFYMUWQNRALU-UHFFFAOYSA-N
XLogP2.86
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.23
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2R)-5-methyl-N-(2,2,2-trifluoroethyl)hexan-2-amine
CID 28371045
5-methyl-N-(2,2,2-trifluoroethyl)hexan-2-amine
CID 43185242
4,4-difluoro-1-methyl-N-propan-2-ylcyclohexan-1-amine
CID 58799781
N-(cyclopentylmethyl)-2,2-difluoroethanamine
CID 60922659
3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine
CID 64499937
3-methyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine
CID 64499938
N-methyl-1-(trifluoromethyl)cyclopentan-1-amine
CID 66204745
1,1,1-trifluoro-N,5-dimethylhexan-2-amine
CID 66466325
(1R,3S)-3-ethyl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine
CID 70643219
1-(difluoromethyl)-N-methylcyclopentan-1-amine
CID 80605622
N-[(4,4-Difluorocyclohexyl)methyl]cyclopentanamine
CID 81931123
N-methyl-3-(trifluoromethyl)cyclopentan-1-amine
CID 83914428

Frequently Asked Questions

What is the IUPAC name of N-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine?
The IUPAC name of N-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine (CID 66615241) is N-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine.
What is the SMILES notation for N-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine?
The canonical SMILES for N-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine is CC(C)NC1(C(F)(F)F)CCCC1.
What is the InChIKey of N-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine?
The InChIKey is DTGFYMUWQNRALU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16F3N/c1-7(2)13-8(9(10,11)12)5-3-4-6-8/h7,13H,3-6H2,1-2H3.
What are the key properties of N-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine?
N-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine has a molecular weight of 195.23 g/mol, XLogP of 2.86, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-propan-2-yl-1-(trifluoromethyl)cyclopentan-1-amine is sourced from PubChem (CID 66615241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).