N-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine

C10H14F3N3 — CID 66151603

IUPACN-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine
SMILESFC(F)(F)CCn1cncc1CNC1CC1
InChIInChI=1S/C10H14F3N3/c11-10(12,13)3-4-16-7-14-5-9(16)6-15-8-1-2-8/h5,7-8,15H,1-4,6H2
InChIKeyDTMRPQLUPYJABU-UHFFFAOYSA-N
MW233.24 g/mol
LogP2.09
Rot. Bonds5

About N-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine

N-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine (PubChem CID 66151603) has the molecular formula C10H14F3N3 and a molecular weight of 233.24 g/mol. Its IUPAC name is N-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine
PubChem CID66151603
Molecular FormulaC10H14F3N3
Molecular Weight233.24 g/mol
Exact Mass233.11
IUPAC NameN-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine
SMILESFC(F)(F)CCn1cncc1CNC1CC1
InChIInChI=1S/C10H14F3N3/c11-10(12,13)3-4-16-7-14-5-9(16)6-15-8-1-2-8/h5,7-8,15H,1-4,6H2
InChIKeyDTMRPQLUPYJABU-UHFFFAOYSA-N
XLogP2.09
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.24
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine 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

4-propyl-N-[(3-propylimidazol-4-yl)methyl]cyclohexan-1-amine
CID 66129378
N-[[3-(3-methoxypropyl)imidazol-4-yl]methyl]cyclopropanamine
CID 66146516
N-[[3-[3-(diethylamino)propyl]imidazol-4-yl]methyl]cyclopropanamine
CID 66146507
N-[[3-(cyclobutylmethyl)imidazol-4-yl]methyl]cyclopropanamine
CID 66148807
1-propyl-N-[(3-propylimidazol-4-yl)methyl]piperidin-4-amine
CID 66134778
N-[[3-[(1-methylpiperidin-4-yl)methyl]imidazol-4-yl]methyl]cyclopropanamine
CID 66150734
N-[[3-[3-(2-methoxyethoxy)propyl]imidazol-4-yl]methyl]cyclopropanamine
CID 114097853
N-[(3-propylimidazol-4-yl)methyl]-3-(trifluoromethyl)cyclohexan-1-amine
CID 66130357
N-[[3-[(4-chlorophenyl)methyl]imidazol-4-yl]methyl]cyclopropanamine
CID 66147318
N-[(3-propylimidazol-4-yl)methyl]cyclohex-3-en-1-amine
CID 66129398
N-[[3-[(4-methyl-1,2,4-triazol-3-yl)methyl]imidazol-4-yl]methyl]cyclopropanamine
CID 66150756
N-[[3-[2-(2,4-dichlorophenyl)ethyl]imidazol-4-yl]methyl]cyclopropanamine
CID 66146075

Frequently Asked Questions

What is the IUPAC name of N-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine?
The IUPAC name of N-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine (CID 66151603) is N-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine?
The canonical SMILES for N-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine is FC(F)(F)CCn1cncc1CNC1CC1.
What is the InChIKey of N-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine?
The InChIKey is DTMRPQLUPYJABU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F3N3/c11-10(12,13)3-4-16-7-14-5-9(16)6-15-8-1-2-8/h5,7-8,15H,1-4,6H2.
What are the key properties of N-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine?
N-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine has a molecular weight of 233.24 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(3,3,3-trifluoropropyl)imidazol-4-yl]methyl]cyclopropanamine is sourced from PubChem (CID 66151603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).