[2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine

C15H20ClNO — CID 65006500

IUPAC[2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine
SMILESNCC1(c2ccccc2Cl)CC2(CCOCC2)C1
InChIInChI=1S/C15H20ClNO/c16-13-4-2-1-3-12(13)15(11-17)9-14(10-15)5-7-18-8-6-14/h1-4H,5-11,17H2
InChIKeyKYLMTSCVXGWQFZ-UHFFFAOYSA-N
MW265.78 g/mol
LogP3.13
Rot. Bonds2

About [2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine

[2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine (PubChem CID 65006500) has the molecular formula C15H20ClNO and a molecular weight of 265.78 g/mol. Its IUPAC name is [2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine.

Molecular Properties

Compound Name[2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine
PubChem CID65006500
Molecular FormulaC15H20ClNO
Molecular Weight265.78 g/mol
Exact Mass265.12
IUPAC Name[2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine
SMILESNCC1(c2ccccc2Cl)CC2(CCOCC2)C1
InChIInChI=1S/C15H20ClNO/c16-13-4-2-1-3-12(13)15(11-17)9-14(10-15)5-7-18-8-6-14/h1-4H,5-11,17H2
InChIKeyKYLMTSCVXGWQFZ-UHFFFAOYSA-N
XLogP3.13
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.78
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-amine
CID 65006357
2-[4-(2-chlorophenyl)oxan-4-yl]ethanamine
CID 82084431
[1-(2-chlorophenyl)cyclopropyl]methanamine;hydrochloride
CID 46736468
[5-(3-chloro-2-fluorophenyl)spiro[2.3]hexan-5-yl]methanamine
CID 82802471
[2-(2-chlorophenyl)sulfanyl-7-oxaspiro[3.5]nonan-2-yl]methanamine
CID 66155248
[5-(2-fluorophenyl)spiro[2.3]hexan-5-yl]methanamine
CID 65008487
[1-(2-chlorophenyl)-3,3-difluorocyclopentyl]methanamine
CID 115045654
[2-(2-fluorophenyl)spiro[3.4]octan-2-yl]methanamine
CID 65003215
2-amino-N-[[4-(2-chlorophenyl)oxan-4-yl]methyl]acetamide;hydrochloride
CID 119320209
1-[5-(2-chlorophenyl)spiro[2.3]hexan-5-yl]-N-methylmethanamine
CID 65008337
4-(2-chlorophenyl)oxan-4-ol
CID 63220219
[2-(2-methylphenyl)spiro[3.4]octan-2-yl]methanamine
CID 65002721

Frequently Asked Questions

What is the IUPAC name of [2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine?
The IUPAC name of [2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine (CID 65006500) is [2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine.
What is the SMILES notation for [2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine?
The canonical SMILES for [2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine is NCC1(c2ccccc2Cl)CC2(CCOCC2)C1.
What is the InChIKey of [2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine?
The InChIKey is KYLMTSCVXGWQFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO/c16-13-4-2-1-3-12(13)15(11-17)9-14(10-15)5-7-18-8-6-14/h1-4H,5-11,17H2.
What are the key properties of [2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine?
[2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine has a molecular weight of 265.78 g/mol, XLogP of 3.13, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chlorophenyl)-7-oxaspiro[3.5]nonan-2-yl]methanamine is sourced from PubChem (CID 65006500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).