(2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine

C14H26F3N — CID 166767119

IUPAC(2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine
SMILESCCC[C@@H](C)N(CC1CC1)[C@H](C(C)C)C(F)(F)F
InChIInChI=1S/C14H26F3N/c1-5-6-11(4)18(9-12-7-8-12)13(10(2)3)14(15,16)17/h10-13H,5-9H2,1-4H3/t11-,13-/m1/s1
InChIKeyQFILGYSRRHSWIP-DGCLKSJQSA-N
MW265.36 g/mol
LogP4.47
Rot. Bonds7

About (2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine

(2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine (PubChem CID 166767119) has the molecular formula C14H26F3N and a molecular weight of 265.36 g/mol. Its IUPAC name is (2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine.

Molecular Properties

Compound Name(2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine
PubChem CID166767119
Molecular FormulaC14H26F3N
Molecular Weight265.36 g/mol
Exact Mass265.20
IUPAC Name(2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine
SMILESCCC[C@@H](C)N(CC1CC1)[C@H](C(C)C)C(F)(F)F
InChIInChI=1S/C14H26F3N/c1-5-6-11(4)18(9-12-7-8-12)13(10(2)3)14(15,16)17/h10-13H,5-9H2,1-4H3/t11-,13-/m1/s1
InChIKeyQFILGYSRRHSWIP-DGCLKSJQSA-N
XLogP4.47
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine?
The IUPAC name of (2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine (CID 166767119) is (2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine.
What is the SMILES notation for (2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine?
The canonical SMILES for (2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine is CCC[C@@H](C)N(CC1CC1)[C@H](C(C)C)C(F)(F)F.
What is the InChIKey of (2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine?
The InChIKey is QFILGYSRRHSWIP-DGCLKSJQSA-N. The full InChI is InChI=1S/C14H26F3N/c1-5-6-11(4)18(9-12-7-8-12)13(10(2)3)14(15,16)17/h10-13H,5-9H2,1-4H3/t11-,13-/m1/s1.
What are the key properties of (2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine?
(2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine has a molecular weight of 265.36 g/mol, XLogP of 4.47, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(cyclopropylmethyl)-1,1,1-trifluoro-3-methyl-N-[(2R)-pentan-2-yl]butan-2-amine is sourced from PubChem (CID 166767119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).