azane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine

C16H26N2 — CID 174742418

IUPACazane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine
SMILESCC1(C)CCCN(C2CC2c2ccccc2)C1.N
InChIInChI=1S/C16H23N.H3N/c1-16(2)9-6-10-17(12-16)15-11-14(15)13-7-4-3-5-8-13;/h3-5,7-8,14-15H,6,9-12H2,1-2H3;1H3
InChIKeyWQKUKBGQSHNWBX-UHFFFAOYSA-N
MW246.40 g/mol
LogP3.83
Rot. Bonds2

About azane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine

azane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine (PubChem CID 174742418) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is azane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine.

Molecular Properties

Compound Nameazane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine
PubChem CID174742418
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Nameazane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine
SMILESCC1(C)CCCN(C2CC2c2ccccc2)C1.N
InChIInChI=1S/C16H23N.H3N/c1-16(2)9-6-10-17(12-16)15-11-14(15)13-7-4-3-5-8-13;/h3-5,7-8,14-15H,6,9-12H2,1-2H3;1H3
InChIKeyWQKUKBGQSHNWBX-UHFFFAOYSA-N
XLogP3.83
TPSA38.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of azane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine?
The IUPAC name of azane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine (CID 174742418) is azane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine.
What is the SMILES notation for azane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine?
The canonical SMILES for azane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine is CC1(C)CCCN(C2CC2c2ccccc2)C1.N.
What is the InChIKey of azane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine?
The InChIKey is WQKUKBGQSHNWBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N.H3N/c1-16(2)9-6-10-17(12-16)15-11-14(15)13-7-4-3-5-8-13;/h3-5,7-8,14-15H,6,9-12H2,1-2H3;1H3.
What are the key properties of azane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine?
azane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine has a molecular weight of 246.40 g/mol, XLogP of 3.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;3,3-dimethyl-1-(2-phenylcyclopropyl)piperidine is sourced from PubChem (CID 174742418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).