N-nonyl-1-(trifluoromethyl)cyclopropan-1-amine

C13H24F3N — CID 106212400

IUPACN-nonyl-1-(trifluoromethyl)cyclopropan-1-amine
SMILESCCCCCCCCCNC1(C(F)(F)F)CC1
InChIInChI=1S/C13H24F3N/c1-2-3-4-5-6-7-8-11-17-12(9-10-12)13(14,15)16/h17H,2-11H2,1H3
InChIKeySKMCAJUYJIUXRM-UHFFFAOYSA-N
MW251.34 g/mol
LogP4.42
Rot. Bonds9

About N-nonyl-1-(trifluoromethyl)cyclopropan-1-amine

N-nonyl-1-(trifluoromethyl)cyclopropan-1-amine (PubChem CID 106212400) has the molecular formula C13H24F3N and a molecular weight of 251.34 g/mol. Its IUPAC name is N-nonyl-1-(trifluoromethyl)cyclopropan-1-amine.

Molecular Properties

Compound NameN-nonyl-1-(trifluoromethyl)cyclopropan-1-amine
PubChem CID106212400
Molecular FormulaC13H24F3N
Molecular Weight251.34 g/mol
Exact Mass251.19
IUPAC NameN-nonyl-1-(trifluoromethyl)cyclopropan-1-amine
SMILESCCCCCCCCCNC1(C(F)(F)F)CC1
InChIInChI=1S/C13H24F3N/c1-2-3-4-5-6-7-8-11-17-12(9-10-12)13(14,15)16/h17H,2-11H2,1H3
InChIKeySKMCAJUYJIUXRM-UHFFFAOYSA-N
XLogP4.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.34
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-decyl-1-(trifluoromethyl)cyclopropan-1-amine
CID 106210328
N-propyl-N'-[1-(trifluoromethyl)cyclopropyl]ethane-1,2-diamine
CID 106219094
N-propyl-1-(trifluoromethyl)cyclopentan-1-amine
CID 66206814
3-[[1-(trifluoromethyl)cyclopropyl]amino]propan-1-ol
CID 106212158
N-propyl-1-(trifluoromethyl)cyclododecan-1-amine
CID 66206608
N-(2-ethoxyethyl)-1-(trifluoromethyl)cyclopropan-1-amine
CID 106212436
1-methyl-N-propyl-4-(trifluoromethyl)piperidin-4-amine
CID 66205990
N-(2,2,2-trifluoroethoxy)dodecan-1-amine
CID 82721644
N-decyl-1-methylcyclohexan-1-amine
CID 63491392
N-(2-methoxyethyl)-N'-[1-(trifluoromethyl)cyclopropyl]ethane-1,2-diamine
CID 106219170
N-(trifluoromethyl)hexadecan-1-amine
CID 158402254
1-methyl-N-pentylcyclopentan-1-amine
CID 61365384

Frequently Asked Questions

What is the IUPAC name of N-nonyl-1-(trifluoromethyl)cyclopropan-1-amine?
The IUPAC name of N-nonyl-1-(trifluoromethyl)cyclopropan-1-amine (CID 106212400) is N-nonyl-1-(trifluoromethyl)cyclopropan-1-amine.
What is the SMILES notation for N-nonyl-1-(trifluoromethyl)cyclopropan-1-amine?
The canonical SMILES for N-nonyl-1-(trifluoromethyl)cyclopropan-1-amine is CCCCCCCCCNC1(C(F)(F)F)CC1.
What is the InChIKey of N-nonyl-1-(trifluoromethyl)cyclopropan-1-amine?
The InChIKey is SKMCAJUYJIUXRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24F3N/c1-2-3-4-5-6-7-8-11-17-12(9-10-12)13(14,15)16/h17H,2-11H2,1H3.
What are the key properties of N-nonyl-1-(trifluoromethyl)cyclopropan-1-amine?
N-nonyl-1-(trifluoromethyl)cyclopropan-1-amine has a molecular weight of 251.34 g/mol, XLogP of 4.42, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-nonyl-1-(trifluoromethyl)cyclopropan-1-amine is sourced from PubChem (CID 106212400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).