2-methylspiro[2.4]heptan-7-amine

C8H15N — CID 146817135

IUPAC2-methylspiro[2.4]heptan-7-amine
SMILESCC1CC12CCCC2N
InChIInChI=1S/C8H15N/c1-6-5-8(6)4-2-3-7(8)9/h6-7H,2-5,9H2,1H3
InChIKeySBHXVJZXMGKQKJ-UHFFFAOYSA-N
MW125.22 g/mol
LogP1.52
Rot. Bonds

About 2-methylspiro[2.4]heptan-7-amine

2-methylspiro[2.4]heptan-7-amine (PubChem CID 146817135) has the molecular formula C8H15N and a molecular weight of 125.22 g/mol. Its IUPAC name is 2-methylspiro[2.4]heptan-7-amine.

Molecular Properties

Compound Name2-methylspiro[2.4]heptan-7-amine
PubChem CID146817135
Molecular FormulaC8H15N
Molecular Weight125.22 g/mol
Exact Mass125.12
IUPAC Name2-methylspiro[2.4]heptan-7-amine
SMILESCC1CC12CCCC2N
InChIInChI=1S/C8H15N/c1-6-5-8(6)4-2-3-7(8)9/h6-7H,2-5,9H2,1H3
InChIKeySBHXVJZXMGKQKJ-UHFFFAOYSA-N
XLogP1.52
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.22
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(4R)-spiro[4.4]nonane-4,9-diamine
CID 67207240
(4R,9R)-spiro[4.4]nonane-4,9-diamine
CID 45098389
11-methylspiro[5.5]undecan-5-amine
CID 138665061
6,8-dimethylspiro[2.5]octan-2-amine
CID 64755024
N-(9-aminospiro[4.4]nonan-4-yl)acetamide
CID 121370272
trans-(1S,3S)-2,2,3-trimethylcyclohexan-1-amine
CID 96559139
5,5,7-trimethylspiro[2.4]heptan-2-amine
CID 106663995
2,2-diethylcyclopentan-1-amine
CID 165447049
3-methyltricyclo[3.3.0.01,4]octane
CID 123792229
2-(bromomethyl)-8-methylspiro[2.5]octane
CID 81351055
(3-methyl-1,2,3,4,5,6,7,7a-octahydroinden-3a-yl)methanamine
CID 83980314
(1R,2R,3S,3'S,4S)-3'-methylspiro[bicyclo[2.2.1]heptane-3,1'-cyclohexane]-2-amine
CID 164833722

Frequently Asked Questions

What is the IUPAC name of 2-methylspiro[2.4]heptan-7-amine?
The IUPAC name of 2-methylspiro[2.4]heptan-7-amine (CID 146817135) is 2-methylspiro[2.4]heptan-7-amine.
What is the SMILES notation for 2-methylspiro[2.4]heptan-7-amine?
The canonical SMILES for 2-methylspiro[2.4]heptan-7-amine is CC1CC12CCCC2N.
What is the InChIKey of 2-methylspiro[2.4]heptan-7-amine?
The InChIKey is SBHXVJZXMGKQKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-6-5-8(6)4-2-3-7(8)9/h6-7H,2-5,9H2,1H3.
What are the key properties of 2-methylspiro[2.4]heptan-7-amine?
2-methylspiro[2.4]heptan-7-amine has a molecular weight of 125.22 g/mol, XLogP of 1.52, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylspiro[2.4]heptan-7-amine is sourced from PubChem (CID 146817135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).