N-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine

C15H22N2 — CID 116988705

IUPACN-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine
SMILESc1cc(CNC2CC2)cc(C2CCCNC2)c1
InChIInChI=1S/C15H22N2/c1-3-12(10-17-15-6-7-15)9-13(4-1)14-5-2-8-16-11-14/h1,3-4,9,14-17H,2,5-8,10-11H2
InChIKeyYQGFHUKIVWDRCU-UHFFFAOYSA-N
MW230.35 g/mol
LogP2.41
Rot. Bonds4

About N-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine

N-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine (PubChem CID 116988705) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is N-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine.

Molecular Properties

Compound NameN-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine
PubChem CID116988705
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC NameN-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine
SMILESc1cc(CNC2CC2)cc(C2CCCNC2)c1
InChIInChI=1S/C15H22N2/c1-3-12(10-17-15-6-7-15)9-13(4-1)14-5-2-8-16-11-14/h1,3-4,9,14-17H,2,5-8,10-11H2
InChIKeyYQGFHUKIVWDRCU-UHFFFAOYSA-N
XLogP2.41
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(3-piperidin-3-ylphenyl)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

N-methyl-1-(3-piperidin-3-ylphenyl)methanamine
CID 116988688
(3-piperidin-3-ylphenyl)methanamine
CID 82603658
N-[(3-cyclopropylphenyl)methyl]cyclopentanamine
CID 79979605
1-(3-piperidin-3-ylphenyl)propan-2-ol
CID 117116416
4-[(3-cyclopropylphenyl)methylamino]cyclohexan-1-ol
CID 79979684
N-[(3-bromophenyl)methyl]azepan-4-amine
CID 103981810
(3S)-3-(3-ethylphenyl)pyrrolidine
CID 130943916
3-piperidin-3-ylbenzenethiol
CID 116988736
3-[(azepan-4-ylamino)methyl]benzonitrile
CID 103981588
N-[(3-nitrophenyl)methyl]piperidin-3-amine
CID 55083688
(3S)-3-(3-fluorophenyl)piperidine;hydrochloride
CID 45074276
N-[(3-cyclopropylphenyl)methyl]-2,3-dihydro-1H-inden-2-amine
CID 107849884

Frequently Asked Questions

What is the IUPAC name of N-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine?
The IUPAC name of N-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine (CID 116988705) is N-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine.
What is the SMILES notation for N-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine?
The canonical SMILES for N-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine is c1cc(CNC2CC2)cc(C2CCCNC2)c1.
What is the InChIKey of N-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine?
The InChIKey is YQGFHUKIVWDRCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-3-12(10-17-15-6-7-15)9-13(4-1)14-5-2-8-16-11-14/h1,3-4,9,14-17H,2,5-8,10-11H2.
What are the key properties of N-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine?
N-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine has a molecular weight of 230.35 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-piperidin-3-ylphenyl)methyl]cyclopropanamine is sourced from PubChem (CID 116988705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).