1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine

C15H20ClN3O — CID 106874960

IUPAC1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine
SMILESCOC1CCCC2(CN=C(N)N2c2ccccc2Cl)C1
InChIInChI=1S/C15H20ClN3O/c1-20-11-5-4-8-15(9-11)10-18-14(17)19(15)13-7-3-2-6-12(13)16/h2-3,6-7,11H,4-5,8-10H2,1H3,(H2,17,18)
InChIKeyCVVUZHGPLKLVGR-UHFFFAOYSA-N
MW293.80 g/mol
LogP2.80
Rot. Bonds2

About 1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine

1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine (PubChem CID 106874960) has the molecular formula C15H20ClN3O and a molecular weight of 293.80 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine.

Molecular Properties

Compound Name1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine
PubChem CID106874960
Molecular FormulaC15H20ClN3O
Molecular Weight293.80 g/mol
Exact Mass293.13
IUPAC Name1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine
SMILESCOC1CCCC2(CN=C(N)N2c2ccccc2Cl)C1
InChIInChI=1S/C15H20ClN3O/c1-20-11-5-4-8-15(9-11)10-18-14(17)19(15)13-7-3-2-6-12(13)16/h2-3,6-7,11H,4-5,8-10H2,1H3,(H2,17,18)
InChIKeyCVVUZHGPLKLVGR-UHFFFAOYSA-N
XLogP2.80
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.80
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-Fluorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 106874964
1-(3-Fluorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 106874984
1-(2-Fluorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 106874988
N-[1-(aminomethyl)-3-methoxycyclohexyl]-2-chloro-5-fluoroaniline
CID 107527789
1-(2-Chlorophenyl)-7-propan-2-yl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79498961
1-(3-Chlorophenyl)-7-propan-2-yl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79499188
1-(3-Chlorophenyl)-7-propyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79499408
1-(2-Chlorophenyl)-7-propyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79499794
1-(2-Chlorophenyl)-7-ethyl-7-methyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79500210
1-(3-Chlorophenyl)-7-ethyl-7-methyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79500438
1-(4-Chlorophenyl)-7-ethyl-7-methyl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79501759
1-(4-Chlorophenyl)-7-propan-2-yl-8-oxa-1,3-diazaspiro[4.5]dec-2-en-2-amine
CID 79501925

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The IUPAC name of 1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine (CID 106874960) is 1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine.
What is the SMILES notation for 1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The canonical SMILES for 1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine is COC1CCCC2(CN=C(N)N2c2ccccc2Cl)C1.
What is the InChIKey of 1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine?
The InChIKey is CVVUZHGPLKLVGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClN3O/c1-20-11-5-4-8-15(9-11)10-18-14(17)19(15)13-7-3-2-6-12(13)16/h2-3,6-7,11H,4-5,8-10H2,1H3,(H2,17,18).
What are the key properties of 1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine?
1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine has a molecular weight of 293.80 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-7-methoxy-1,3-diazaspiro[4.5]dec-2-en-2-amine is sourced from PubChem (CID 106874960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).