1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine

C11H21F3N2 — CID 114996637

IUPAC1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine
SMILESCC(C)N(CC(F)(F)F)C1(CN)CCCC1
InChIInChI=1S/C11H21F3N2/c1-9(2)16(8-11(12,13)14)10(7-15)5-3-4-6-10/h9H,3-8,15H2,1-2H3
InChIKeyIMCITYSESRHSTQ-UHFFFAOYSA-N
MW238.30 g/mol
LogP2.53
Rot. Bonds4

About 1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine

1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine (PubChem CID 114996637) has the molecular formula C11H21F3N2 and a molecular weight of 238.30 g/mol. Its IUPAC name is 1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine
PubChem CID114996637
Molecular FormulaC11H21F3N2
Molecular Weight238.30 g/mol
Exact Mass238.17
IUPAC Name1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine
SMILESCC(C)N(CC(F)(F)F)C1(CN)CCCC1
InChIInChI=1S/C11H21F3N2/c1-9(2)16(8-11(12,13)14)10(7-15)5-3-4-6-10/h9H,3-8,15H2,1-2H3
InChIKeyIMCITYSESRHSTQ-UHFFFAOYSA-N
XLogP2.53
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.30
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(aminomethyl)-N-(2-methylpropyl)-N-propan-2-ylcyclobutan-1-amine
CID 79520911
1-(aminomethyl)-N-methyl-N-(3,3,3-trifluoropropyl)cycloheptan-1-amine
CID 64552919
1-(aminomethyl)-N-methyl-N-(3,3,3-trifluoropropyl)cyclohexan-1-amine
CID 64552096
1-(aminomethyl)-N-methyl-N-(4,4,4-trifluorobutyl)cyclopentan-1-amine
CID 115513364
4-(aminomethyl)-N-propan-2-yl-N-propyloxepan-4-amine
CID 65079379
1-(aminomethyl)-N-methyl-N-(2-methylpropyl)cyclopentan-1-amine
CID 43271983
3-(aminomethyl)-N-(2-methylpropyl)-1,1-dioxo-N-propan-2-ylthian-3-amine
CID 63922258
1-(aminomethyl)-N-propyl-N-(3,3,3-trifluoropropyl)cycloheptan-1-amine
CID 64553128
1-[2-[propan-2-yl(2,2,2-trifluoroethyl)amino]ethyl]cyclohexan-1-amine
CID 64682252
1-(aminomethyl)-1-[ethyl(2,2,2-trifluoroethylsulfamoyl)amino]cyclopentane
CID 114803859
1-(aminomethyl)-N-(2,2-dimethylpropyl)-N-methylcyclododecan-1-amine
CID 63467204
1-(aminomethyl)-N-methyl-N-(2-methylpropyl)cyclododecan-1-amine
CID 43271985

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine?
The IUPAC name of 1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine (CID 114996637) is 1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine.
What is the SMILES notation for 1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine?
The canonical SMILES for 1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine is CC(C)N(CC(F)(F)F)C1(CN)CCCC1.
What is the InChIKey of 1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine?
The InChIKey is IMCITYSESRHSTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F3N2/c1-9(2)16(8-11(12,13)14)10(7-15)5-3-4-6-10/h9H,3-8,15H2,1-2H3.
What are the key properties of 1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine?
1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine has a molecular weight of 238.30 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-propan-2-yl-N-(2,2,2-trifluoroethyl)cyclopentan-1-amine is sourced from PubChem (CID 114996637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).