N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine

C10H19F3N2 — CID 62370891

IUPACN-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine
SMILESCC(C)N(CC1CCNC1)CC(F)(F)F
InChIInChI=1S/C10H19F3N2/c1-8(2)15(7-10(11,12)13)6-9-3-4-14-5-9/h8-9,14H,3-7H2,1-2H3
InChIKeyYJBOHJSAHQSHQV-UHFFFAOYSA-N
MW224.27 g/mol
LogP1.87
Rot. Bonds4

About N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine

N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine (PubChem CID 62370891) has the molecular formula C10H19F3N2 and a molecular weight of 224.27 g/mol. Its IUPAC name is N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine.

Molecular Properties

Compound NameN-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine
PubChem CID62370891
Molecular FormulaC10H19F3N2
Molecular Weight224.27 g/mol
Exact Mass224.15
IUPAC NameN-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine
SMILESCC(C)N(CC1CCNC1)CC(F)(F)F
InChIInChI=1S/C10H19F3N2/c1-8(2)15(7-10(11,12)13)6-9-3-4-14-5-9/h8-9,14H,3-7H2,1-2H3
InChIKeyYJBOHJSAHQSHQV-UHFFFAOYSA-N
XLogP1.87
TPSA15.27 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 ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-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

Related Compounds

3-[[propan-2-yl(2,2,2-trifluoroethyl)amino]methyl]cyclopentan-1-amine
CID 66010505
N-[[(2S)-pyrrolidin-2-yl]methyl]-N-(2,2,2-trifluoroethyl)propan-2-amine
CID 102819434
N-benzyl-N-[[(3R)-pyrrolidin-3-yl]methyl]propan-2-amine
CID 94408590
N-(cycloheptylmethyl)-N-(piperidin-3-ylmethyl)propan-2-amine
CID 106624258
N-(piperidin-3-ylmethyl)-N-[2-(trifluoromethoxy)ethyl]propan-2-amine
CID 106637776
2-[piperidin-3-ylmethyl(propan-2-yl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 106637814
N-[(3,5-dichlorophenyl)methyl]-N-[[(3R)-pyrrolidin-3-yl]methyl]propan-2-amine
CID 11680997
2-methyl-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-1-amine;hydrochloride
CID 119930509
2-phenyl-1-[piperidin-3-ylmethyl(propan-2-yl)amino]propan-2-ol
CID 106637768
3,3-difluoro-N-methyl-N-(pyrrolidin-3-ylmethyl)butan-1-amine
CID 84674397
N,N-dimethyl-1-pyrrolidin-3-ylmethanamine;dihydrochloride
CID 23145859
2-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-1-amine
CID 103815885

Frequently Asked Questions

What is the IUPAC name of N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine?
The IUPAC name of N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine (CID 62370891) is N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine.
What is the SMILES notation for N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine?
The canonical SMILES for N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine is CC(C)N(CC1CCNC1)CC(F)(F)F.
What is the InChIKey of N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine?
The InChIKey is YJBOHJSAHQSHQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2/c1-8(2)15(7-10(11,12)13)6-9-3-4-14-5-9/h8-9,14H,3-7H2,1-2H3.
What are the key properties of N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine?
N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine has a molecular weight of 224.27 g/mol, XLogP of 1.87, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyrrolidin-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-2-amine is sourced from PubChem (CID 62370891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).