N-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine

C15H22F2N2 — CID 115708311

IUPACN-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine
SMILESCCCN1CCC(NCc2cc(F)cc(F)c2)CC1
InChIInChI=1S/C15H22F2N2/c1-2-5-19-6-3-15(4-7-19)18-11-12-8-13(16)10-14(17)9-12/h8-10,15,18H,2-7,11H2,1H3
InChIKeyANUGVMFGAIVMEG-UHFFFAOYSA-N
MW268.35 g/mol
LogP2.93
Rot. Bonds5

About N-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine

N-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine (PubChem CID 115708311) has the molecular formula C15H22F2N2 and a molecular weight of 268.35 g/mol. Its IUPAC name is N-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine.

Molecular Properties

Compound NameN-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine
PubChem CID115708311
Molecular FormulaC15H22F2N2
Molecular Weight268.35 g/mol
Exact Mass268.18
IUPAC NameN-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine
SMILESCCCN1CCC(NCc2cc(F)cc(F)c2)CC1
InChIInChI=1S/C15H22F2N2/c1-2-5-19-6-3-15(4-7-19)18-11-12-8-13(16)10-14(17)9-12/h8-10,15,18H,2-7,11H2,1H3
InChIKeyANUGVMFGAIVMEG-UHFFFAOYSA-N
XLogP2.93
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.35
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-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

2,6-dibromo-4-[[(1-propylpiperidin-4-yl)amino]methyl]phenol
CID 103603286
1-tert-butyl-N-[(3,5-difluorophenyl)methyl]piperidin-4-amine
CID 103776736
2-fluoro-4-[[(1-propylpiperidin-4-yl)amino]methyl]benzoic acid
CID 106699931
N-[(4-iodophenyl)methyl]-1-propylpiperidin-4-amine
CID 65479012
1-propyl-N-[(1-propylpyrrol-3-yl)methyl]piperidin-4-amine
CID 66397545
CID 140622478
CID 140622478
N-[(3-bromo-5-nitrophenyl)methyl]-1-propylpiperidin-4-amine
CID 103350689
N-[(1-ethylpyrazol-4-yl)methyl]-1-propylpiperidin-4-amine
CID 62127257
N-[[3-fluoro-4-(4-propylpiperazin-1-yl)phenyl]methyl]cyclopropanamine
CID 43281201
N-[[4-[(4-propylpiperazin-1-yl)methyl]phenyl]methyl]cyclopropanamine
CID 62423801
N-[(4-bromo-3-fluorophenyl)methyl]-1-butylpiperidin-4-amine
CID 81002478
N-[(3,5-difluorophenyl)methyl]piperidin-4-amine
CID 68801078

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine?
The IUPAC name of N-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine (CID 115708311) is N-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine.
What is the SMILES notation for N-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine?
The canonical SMILES for N-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine is CCCN1CCC(NCc2cc(F)cc(F)c2)CC1.
What is the InChIKey of N-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine?
The InChIKey is ANUGVMFGAIVMEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22F2N2/c1-2-5-19-6-3-15(4-7-19)18-11-12-8-13(16)10-14(17)9-12/h8-10,15,18H,2-7,11H2,1H3.
What are the key properties of N-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine?
N-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine has a molecular weight of 268.35 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-difluorophenyl)methyl]-1-propylpiperidin-4-amine is sourced from PubChem (CID 115708311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).