3-(1-phenylcyclopropyl)piperidine;hydrochloride

C14H20ClN — CID 162342001

IUPAC3-(1-phenylcyclopropyl)piperidine;hydrochloride
SMILESCl.c1ccc(C2(C3CCCNC3)CC2)cc1
InChIInChI=1S/C14H19N.ClH/c1-2-5-12(6-3-1)14(8-9-14)13-7-4-10-15-11-13;/h1-3,5-6,13,15H,4,7-11H2;1H
InChIKeyMTIPWZAIBWQERX-UHFFFAOYSA-N
MW237.77 g/mol
LogP3.14
Rot. Bonds2

About 3-(1-phenylcyclopropyl)piperidine;hydrochloride

3-(1-phenylcyclopropyl)piperidine;hydrochloride (PubChem CID 162342001) has the molecular formula C14H20ClN and a molecular weight of 237.77 g/mol. Its IUPAC name is 3-(1-phenylcyclopropyl)piperidine;hydrochloride.

Molecular Properties

Compound Name3-(1-phenylcyclopropyl)piperidine;hydrochloride
PubChem CID162342001
Molecular FormulaC14H20ClN
Molecular Weight237.77 g/mol
Exact Mass237.13
IUPAC Name3-(1-phenylcyclopropyl)piperidine;hydrochloride
SMILESCl.c1ccc(C2(C3CCCNC3)CC2)cc1
InChIInChI=1S/C14H19N.ClH/c1-2-5-12(6-3-1)14(8-9-14)13-7-4-10-15-11-13;/h1-3,5-6,13,15H,4,7-11H2;1H
InChIKeyMTIPWZAIBWQERX-UHFFFAOYSA-N
XLogP3.14
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.77
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-phenyl-4-pyrrolidin-3-ylcyclohexan-1-one
CID 57475104
1-phenyl-3-azabicyclo[3.2.0]heptane
CID 84766513
4-(1-phenylcyclopentyl)piperidine
CID 83911457
8a-phenyl-2,3,4,4a,5,6,7,8-octahydro-1H-naphthalene
CID 611743
ethane;1-phenyl-3-azabicyclo[3.2.0]heptane
CID 143290504
3-[1-(3-chlorophenyl)cyclopropyl]pyrrolidine
CID 83910690
3-[1-(3-bromophenyl)cyclopropyl]pyrrolidine
CID 83913423
3-(1-pyrrolidin-3-ylcyclopentyl)pyridine
CID 83910049
[3-(2,3,4,5,6,7,8,8a-octahydro-1H-cyclopenta[c]azepin-5a-yl)phenyl] acetate
CID 21330525
1-phenylbicyclo[4.1.0]heptane
CID 582374
1-piperidin-3-ylcyclopropan-1-ol;hydrochloride
CID 127264219
3-[1-(4-bromophenyl)cyclopropyl]azetidine;hydrochloride
CID 155819891

Frequently Asked Questions

What is the IUPAC name of 3-(1-phenylcyclopropyl)piperidine;hydrochloride?
The IUPAC name of 3-(1-phenylcyclopropyl)piperidine;hydrochloride (CID 162342001) is 3-(1-phenylcyclopropyl)piperidine;hydrochloride.
What is the SMILES notation for 3-(1-phenylcyclopropyl)piperidine;hydrochloride?
The canonical SMILES for 3-(1-phenylcyclopropyl)piperidine;hydrochloride is Cl.c1ccc(C2(C3CCCNC3)CC2)cc1.
What is the InChIKey of 3-(1-phenylcyclopropyl)piperidine;hydrochloride?
The InChIKey is MTIPWZAIBWQERX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N.ClH/c1-2-5-12(6-3-1)14(8-9-14)13-7-4-10-15-11-13;/h1-3,5-6,13,15H,4,7-11H2;1H.
What are the key properties of 3-(1-phenylcyclopropyl)piperidine;hydrochloride?
3-(1-phenylcyclopropyl)piperidine;hydrochloride has a molecular weight of 237.77 g/mol, XLogP of 3.14, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-phenylcyclopropyl)piperidine;hydrochloride is sourced from PubChem (CID 162342001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).