N,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine

C10H18F3N — CID 139711377

IUPACN,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine
SMILESCN(C)CC1CCC(C(F)(F)F)CC1
InChIInChI=1S/C10H18F3N/c1-14(2)7-8-3-5-9(6-4-8)10(11,12)13/h8-9H,3-7H2,1-2H3
InChIKeyVRAHZXLZKFNEDP-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.92
Rot. Bonds2

About N,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine

N,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine (PubChem CID 139711377) has the molecular formula C10H18F3N and a molecular weight of 209.25 g/mol. Its IUPAC name is N,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine
PubChem CID139711377
Molecular FormulaC10H18F3N
Molecular Weight209.25 g/mol
Exact Mass209.14
IUPAC NameN,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine
SMILESCN(C)CC1CCC(C(F)(F)F)CC1
InChIInChI=1S/C10H18F3N/c1-14(2)7-8-3-5-9(6-4-8)10(11,12)13/h8-9H,3-7H2,1-2H3
InChIKeyVRAHZXLZKFNEDP-UHFFFAOYSA-N
XLogP2.92
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclobutyl-N,N-dimethylmethanamine
CID 4285302
N,N'-dimethyl-N'-[[4-(trifluoromethyl)cyclohexyl]methyl]ethane-1,2-diamine
CID 113408998
1-cycloheptyl-N,N-dimethylmethanamine
CID 58845214
N-methyl-N-(piperidin-4-ylmethyl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 79708298
1-ethyl-4-[1,1,2,2-tetrafluoro-2-[4-(trifluoromethyl)cyclohexyl]ethyl]cyclohexane
CID 101139965
1-(2-methylpropyl)-4-(trifluoromethyl)cyclohexane
CID 71231425
1-methyl-4-[[4-(trifluoromethyl)cyclohexyl]methyl]cyclohexane
CID 59015376
N-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide
CID 75502533
1-(aminomethyl)-N-(cyclohexylmethyl)-N-methyl-4-(trifluoromethyl)cyclohexan-1-amine
CID 64755111
carbanide;cobalt(2+);heptakis(cyclopentane);1-cyclopentyl-N,N-dimethylmethanamine;bis(iron(2+));nickel(2+)
CID 162293129
N-ethyl-N-(piperidin-4-ylmethyl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 79715457
1-(aminomethyl)-N-cyclopropyl-N-(cyclopropylmethyl)-4-(trifluoromethyl)cyclohexan-1-amine
CID 64755328

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine?
The IUPAC name of N,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine (CID 139711377) is N,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine is CN(C)CC1CCC(C(F)(F)F)CC1.
What is the InChIKey of N,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine?
The InChIKey is VRAHZXLZKFNEDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F3N/c1-14(2)7-8-3-5-9(6-4-8)10(11,12)13/h8-9H,3-7H2,1-2H3.
What are the key properties of N,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine?
N,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine has a molecular weight of 209.25 g/mol, XLogP of 2.92, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine is sourced from PubChem (CID 139711377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).