N'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine

C10H19F3N2 — CID 103366115

IUPACN'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine
SMILESCN(CC(CN)C(F)(F)F)C1CCCC1
InChIInChI=1S/C10H19F3N2/c1-15(9-4-2-3-5-9)7-8(6-14)10(11,12)13/h8-9H,2-7,14H2,1H3
InChIKeyKYPNDOSPACLDOM-UHFFFAOYSA-N
MW224.27 g/mol
LogP2.00
Rot. Bonds4

About N'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine

N'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine (PubChem CID 103366115) has the molecular formula C10H19F3N2 and a molecular weight of 224.27 g/mol. Its IUPAC name is N'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine
PubChem CID103366115
Molecular FormulaC10H19F3N2
Molecular Weight224.27 g/mol
Exact Mass224.15
IUPAC NameN'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine
SMILESCN(CC(CN)C(F)(F)F)C1CCCC1
InChIInChI=1S/C10H19F3N2/c1-15(9-4-2-3-5-9)7-8(6-14)10(11,12)13/h8-9H,2-7,14H2,1H3
InChIKeyKYPNDOSPACLDOM-UHFFFAOYSA-N
XLogP2.00
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N'-cyclopentyl-N',2-dimethylpropane-1,3-diamine
CID 43266901
N-methyl-N-(2-methylpropyl)cyclopentanamine
CID 89147388
N'-cyclopropyl-N'-propyl-2-(trifluoromethyl)propane-1,3-diamine
CID 103366118
(2S)-1-N-cyclobutyl-1-N-methylpropane-1,2-diamine
CID 104873486
1-[cyclooctyl(methyl)amino]butan-2-ol
CID 130316324
N'-cyclopentyl-1-cyclopropyl-N'-methylethane-1,2-diamine
CID 63914724
N-cycloheptyl-N,2-dimethylbutane-1,4-diamine
CID 80544341
methane;methanol;N-methyl-N-(2-methylpropyl)cyclobutanamine
CID 155582647
1,3-bis[cyclooctyl(methyl)amino]propan-2-ol
CID 130316337
2-N,2-N-dicyclohexyl-3,3,3-trifluoropropane-1,2-diamine
CID 43752659
2-(trifluoromethyl)butan-1-amine
CID 10351789
3-N-cycloheptyl-4,4,4-trifluoro-3-N-methylbutane-1,3-diamine
CID 43753188

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine?
The IUPAC name of N'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine (CID 103366115) is N'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine.
What is the SMILES notation for N'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine?
The canonical SMILES for N'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine is CN(CC(CN)C(F)(F)F)C1CCCC1.
What is the InChIKey of N'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine?
The InChIKey is KYPNDOSPACLDOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2/c1-15(9-4-2-3-5-9)7-8(6-14)10(11,12)13/h8-9H,2-7,14H2,1H3.
What are the key properties of N'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine?
N'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine has a molecular weight of 224.27 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N'-methyl-2-(trifluoromethyl)propane-1,3-diamine is sourced from PubChem (CID 103366115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).