1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine

C14H26F3N — CID 104992726

IUPAC1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine
SMILESCCCNC(CCC1CCCC1)CCC(F)(F)F
InChIInChI=1S/C14H26F3N/c1-2-11-18-13(9-10-14(15,16)17)8-7-12-5-3-4-6-12/h12-13,18H,2-11H2,1H3
InChIKeyKVXNNALSWQOUDM-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.67
Rot. Bonds8

About 1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine

1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine (PubChem CID 104992726) has the molecular formula C14H26F3N and a molecular weight of 265.36 g/mol. Its IUPAC name is 1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine.

Molecular Properties

Compound Name1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine
PubChem CID104992726
Molecular FormulaC14H26F3N
Molecular Weight265.36 g/mol
Exact Mass265.20
IUPAC Name1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine
SMILESCCCNC(CCC1CCCC1)CCC(F)(F)F
InChIInChI=1S/C14H26F3N/c1-2-11-18-13(9-10-14(15,16)17)8-7-12-5-3-4-6-12/h12-13,18H,2-11H2,1H3
InChIKeyKVXNNALSWQOUDM-UHFFFAOYSA-N
XLogP4.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclohexyl-6,6-dimethyl-N-propylheptan-3-amine
CID 115849970
1-cyclohexyl-N-propylhexan-3-amine
CID 63400154
1-cyclohexyl-6-methoxy-6-methyl-N-propylheptan-3-amine
CID 103031953
1-cyclobutyl-4-cyclopentyl-N-propylbutan-2-amine
CID 115863549
5,5,5-trifluoro-1-(oxan-4-yl)-N-propylpentan-2-amine
CID 79965180
4-cyclohexyl-1-(oxan-4-yl)-N-propylbutan-2-amine
CID 115846851
1-cyclopentyl-4,4,4-trifluoro-N-propylbutan-2-amine
CID 62604821
4-cyclohexyl-1-ethoxy-N-propylbutan-2-amine
CID 105008032
1,1,1-trifluoro-N-propyldodecan-4-amine
CID 79964145
1-ethylsulfanyl-5,5,5-trifluoro-N-propylpentan-2-amine
CID 65128350
3-cyclopentyl-1-cyclopropyl-N-propylpropan-1-amine
CID 63354880
1-cyclohexyl-N-propylpentan-2-amine
CID 63413972

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine?
The IUPAC name of 1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine (CID 104992726) is 1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine.
What is the SMILES notation for 1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine?
The canonical SMILES for 1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine is CCCNC(CCC1CCCC1)CCC(F)(F)F.
What is the InChIKey of 1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine?
The InChIKey is KVXNNALSWQOUDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26F3N/c1-2-11-18-13(9-10-14(15,16)17)8-7-12-5-3-4-6-12/h12-13,18H,2-11H2,1H3.
What are the key properties of 1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine?
1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine has a molecular weight of 265.36 g/mol, XLogP of 4.67, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-6,6,6-trifluoro-N-propylhexan-3-amine is sourced from PubChem (CID 104992726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).