5-phenylspiro[2.3]hexan-5-amine

C12H15N — CID 65008648

IUPAC5-phenylspiro[2.3]hexan-5-amine
SMILESNC1(c2ccccc2)CC2(CC2)C1
InChIInChI=1S/C12H15N/c13-12(8-11(9-12)6-7-11)10-4-2-1-3-5-10/h1-5H,6-9,13H2
InChIKeyBMPCYYWJUTZEMK-UHFFFAOYSA-N
MW173.26 g/mol
LogP2.41
Rot. Bonds1

About 5-phenylspiro[2.3]hexan-5-amine

5-phenylspiro[2.3]hexan-5-amine (PubChem CID 65008648) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 5-phenylspiro[2.3]hexan-5-amine.

Molecular Properties

Compound Name5-phenylspiro[2.3]hexan-5-amine
PubChem CID65008648
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name5-phenylspiro[2.3]hexan-5-amine
SMILESNC1(c2ccccc2)CC2(CC2)C1
InChIInChI=1S/C12H15N/c13-12(8-11(9-12)6-7-11)10-4-2-1-3-5-10/h1-5H,6-9,13H2
InChIKeyBMPCYYWJUTZEMK-UHFFFAOYSA-N
XLogP2.41
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-(3-chlorophenyl)spiro[2.3]hexan-5-amine
CID 65008597
2-phenyl-5,8-dioxaspiro[3.4]octan-2-amine
CID 126480378
2-(4-fluorophenyl)spiro[3.4]octan-2-amine
CID 65002671
5-(3,5-difluorophenyl)spiro[2.3]hexan-5-amine
CID 65008174
4-fluoro-1-phenylcyclohexan-1-amine
CID 83853906
3-phenyloxetan-3-amine;hydrochloride
CID 53256980
5-(2-methoxyphenyl)spiro[2.3]hexan-5-amine
CID 65008758
(4R)-2,2-dimethyl-4-phenyloxan-4-amine
CID 129406245
2-(3-methoxyphenyl)spiro[3.3]heptan-2-amine
CID 65009223
4-methyl-1-phenylcyclohexan-1-amine;hydrochloride
CID 45259718
3,3-diphenylcyclopentane-1,1-diamine
CID 70622248
2-[3-(trifluoromethyl)phenyl]spiro[3.5]nonan-2-amine
CID 65007104

Frequently Asked Questions

What is the IUPAC name of 5-phenylspiro[2.3]hexan-5-amine?
The IUPAC name of 5-phenylspiro[2.3]hexan-5-amine (CID 65008648) is 5-phenylspiro[2.3]hexan-5-amine.
What is the SMILES notation for 5-phenylspiro[2.3]hexan-5-amine?
The canonical SMILES for 5-phenylspiro[2.3]hexan-5-amine is NC1(c2ccccc2)CC2(CC2)C1.
What is the InChIKey of 5-phenylspiro[2.3]hexan-5-amine?
The InChIKey is BMPCYYWJUTZEMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N/c13-12(8-11(9-12)6-7-11)10-4-2-1-3-5-10/h1-5H,6-9,13H2.
What are the key properties of 5-phenylspiro[2.3]hexan-5-amine?
5-phenylspiro[2.3]hexan-5-amine has a molecular weight of 173.26 g/mol, XLogP of 2.41, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenylspiro[2.3]hexan-5-amine is sourced from PubChem (CID 65008648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).