1-spiro[2.2]pentan-2-ylethanamine

C7H13N — CID 130955875

IUPAC1-spiro[2.2]pentan-2-ylethanamine
SMILESCC(N)C1CC12CC2
InChIInChI=1S/C7H13N/c1-5(8)6-4-7(6)2-3-7/h5-6H,2-4,8H2,1H3
InChIKeyPEYVWDVUZAUHEE-UHFFFAOYSA-N
MW111.19 g/mol
LogP1.13
Rot. Bonds1

About 1-spiro[2.2]pentan-2-ylethanamine

1-spiro[2.2]pentan-2-ylethanamine (PubChem CID 130955875) has the molecular formula C7H13N and a molecular weight of 111.19 g/mol. Its IUPAC name is 1-spiro[2.2]pentan-2-ylethanamine.

Molecular Properties

Compound Name1-spiro[2.2]pentan-2-ylethanamine
PubChem CID130955875
Molecular FormulaC7H13N
Molecular Weight111.19 g/mol
Exact Mass111.10
IUPAC Name1-spiro[2.2]pentan-2-ylethanamine
SMILESCC(N)C1CC12CC2
InChIInChI=1S/C7H13N/c1-5(8)6-4-7(6)2-3-7/h5-6H,2-4,8H2,1H3
InChIKeyPEYVWDVUZAUHEE-UHFFFAOYSA-N
XLogP1.13
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.19
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R)-1-spiro[2.2]pentan-2-ylethanamine
CID 164643941
(1R)-1-[(2R)-spiro[2.2]pentan-2-yl]ethanol
CID 131155650
(1S)-1-[(1R)-2,2-dimethylcyclopropyl]ethanamine
CID 90067113
2-methyl-1-spiro[2.2]pentan-2-ylpropan-1-ol
CID 126971945
(1S)-1-[(1R)-2,2-dichlorocyclopropyl]ethanamine
CID 90020083
(1S)-1-[(1S)-2,2-dichlorocyclopropyl]ethanamine;hydrochloride
CID 118207124
2-pentan-2-ylspiro[2.2]pentane
CID 91467438
(2R)-2-propan-2-yl-6λ6-thiaspiro[2.5]octane 6,6-dioxide
CID 176625279
(2S)-2-propan-2-yl-6λ6-thiaspiro[2.5]octane 6,6-dioxide
CID 167079487
1-[2-(1-aminoethyl)cyclobutyl]ethanamine
CID 22627804
(1R)-1-[(1R,2R,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]ethanamine
CID 129408851
1-(2-methyl-2-prop-2-ynylcyclopropyl)ethanamine
CID 163827959

Frequently Asked Questions

What is the IUPAC name of 1-spiro[2.2]pentan-2-ylethanamine?
The IUPAC name of 1-spiro[2.2]pentan-2-ylethanamine (CID 130955875) is 1-spiro[2.2]pentan-2-ylethanamine.
What is the SMILES notation for 1-spiro[2.2]pentan-2-ylethanamine?
The canonical SMILES for 1-spiro[2.2]pentan-2-ylethanamine is CC(N)C1CC12CC2.
What is the InChIKey of 1-spiro[2.2]pentan-2-ylethanamine?
The InChIKey is PEYVWDVUZAUHEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13N/c1-5(8)6-4-7(6)2-3-7/h5-6H,2-4,8H2,1H3.
What are the key properties of 1-spiro[2.2]pentan-2-ylethanamine?
1-spiro[2.2]pentan-2-ylethanamine has a molecular weight of 111.19 g/mol, XLogP of 1.13, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-spiro[2.2]pentan-2-ylethanamine is sourced from PubChem (CID 130955875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).