[(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine

C9H17N — CID 163488510

IUPAC[(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine
SMILESCC1CC2(CC2)C[C@H]1CN
InChIInChI=1S/C9H17N/c1-7-4-9(2-3-9)5-8(7)6-10/h7-8H,2-6,10H2,1H3/t7?,8-/m0/s1
InChIKeyCKPKMSLCZICNDN-MQWKRIRWSA-N
MW139.24 g/mol
LogP1.77
Rot. Bonds1

About [(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine

[(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine (PubChem CID 163488510) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is [(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine.

Molecular Properties

Compound Name[(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine
PubChem CID163488510
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name[(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine
SMILESCC1CC2(CC2)C[C@H]1CN
InChIInChI=1S/C9H17N/c1-7-4-9(2-3-9)5-8(7)6-10/h7-8H,2-6,10H2,1H3/t7?,8-/m0/s1
InChIKeyCKPKMSLCZICNDN-MQWKRIRWSA-N
XLogP1.77
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-methyl-6-propylspiro[2.4]heptane
CID 91059551
5,6-diethylspiro[2.4]heptane
CID 177192839
(2S,3S)-2,3-dimethylspiro[4.4]nonane
CID 58622704
6-methylspiro[2.5]octan-7-amine;hydrochloride
CID 67385635
3-ethyl-4-methylspiro[5.5]undecane
CID 177192246
[(1S)-2,3-dimethylcyclopentyl]methanamine
CID 129279891
(2-methylcyclodecyl)methanamine
CID 163635360
(2,4-dimethylcyclopentyl)methanamine
CID 134314260
7-(aminomethyl)-2,2,5-trimethyl-1,3,3a,4,5,6,7,7a-octahydroinden-4-amine
CID 166684445
[2-(3,4-dimethylcyclohexyl)-4,4-dimethylcyclohexyl]methanamine
CID 81012713
(4-iodo-2-methylcyclopentyl)methanamine
CID 89197571
2-(aminomethyl)-4,4-difluorocyclopentane-1-carboxylic acid
CID 105437824

Frequently Asked Questions

What is the IUPAC name of [(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine?
The IUPAC name of [(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine (CID 163488510) is [(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine.
What is the SMILES notation for [(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine?
The canonical SMILES for [(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine is CC1CC2(CC2)C[C@H]1CN.
What is the InChIKey of [(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine?
The InChIKey is CKPKMSLCZICNDN-MQWKRIRWSA-N. The full InChI is InChI=1S/C9H17N/c1-7-4-9(2-3-9)5-8(7)6-10/h7-8H,2-6,10H2,1H3/t7?,8-/m0/s1.
What are the key properties of [(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine?
[(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine has a molecular weight of 139.24 g/mol, XLogP of 1.77, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(6R)-5-methylspiro[2.4]heptan-6-yl]methanamine is sourced from PubChem (CID 163488510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).