N-(1-cyclopropylethyl)spiro[3.4]octan-3-amine

C13H23N — CID 130611164

IUPACN-(1-cyclopropylethyl)spiro[3.4]octan-3-amine
SMILESCC(NC1CCC12CCCC2)C1CC1
InChIInChI=1S/C13H23N/c1-10(11-4-5-11)14-12-6-9-13(12)7-2-3-8-13/h10-12,14H,2-9H2,1H3
InChIKeyLCGYHEPKSKXUFL-UHFFFAOYSA-N
MW193.33 g/mol
LogP3.10
Rot. Bonds3

About N-(1-cyclopropylethyl)spiro[3.4]octan-3-amine

N-(1-cyclopropylethyl)spiro[3.4]octan-3-amine (PubChem CID 130611164) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)spiro[3.4]octan-3-amine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)spiro[3.4]octan-3-amine
PubChem CID130611164
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC NameN-(1-cyclopropylethyl)spiro[3.4]octan-3-amine
SMILESCC(NC1CCC12CCCC2)C1CC1
InChIInChI=1S/C13H23N/c1-10(11-4-5-11)14-12-6-9-13(12)7-2-3-8-13/h10-12,14H,2-9H2,1H3
InChIKeyLCGYHEPKSKXUFL-UHFFFAOYSA-N
XLogP3.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(1-cyclopropylpropan-2-yl)spiro[3.5]nonan-3-amine
CID 102951940
(2S)-2-(spiro[3.4]octan-3-ylamino)propan-1-ol
CID 131107125
N-pentan-2-ylspiro[3.5]nonan-3-amine
CID 102951172
N-(2-methylpropyl)spiro[3.4]octan-3-amine
CID 131207014
N-(1-cyclopropylethyl)spiro[4.5]decan-8-amine
CID 114817251
N-(1-methoxy-3-methylbutan-2-yl)spiro[3.5]nonan-3-amine
CID 102951989
N-methylspiro[3.5]nonan-3-amine
CID 102951104
N-hexan-3-ylspiro[3.5]nonan-3-amine
CID 102951793
(2S)-1-N-spiro[3.4]octan-3-ylpropane-1,2-diamine
CID 164658810
N-[1-(4-methoxyphenyl)ethyl]spiro[3.5]nonan-3-amine
CID 102952051
2-bromo-N-spiro[3.4]octan-3-ylpropanamide
CID 164649977
N-[(1R)-1-cyclopropylethyl]cyclopropanamine
CID 28819115

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)spiro[3.4]octan-3-amine?
The IUPAC name of N-(1-cyclopropylethyl)spiro[3.4]octan-3-amine (CID 130611164) is N-(1-cyclopropylethyl)spiro[3.4]octan-3-amine.
What is the SMILES notation for N-(1-cyclopropylethyl)spiro[3.4]octan-3-amine?
The canonical SMILES for N-(1-cyclopropylethyl)spiro[3.4]octan-3-amine is CC(NC1CCC12CCCC2)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)spiro[3.4]octan-3-amine?
The InChIKey is LCGYHEPKSKXUFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N/c1-10(11-4-5-11)14-12-6-9-13(12)7-2-3-8-13/h10-12,14H,2-9H2,1H3.
What are the key properties of N-(1-cyclopropylethyl)spiro[3.4]octan-3-amine?
N-(1-cyclopropylethyl)spiro[3.4]octan-3-amine has a molecular weight of 193.33 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)spiro[3.4]octan-3-amine is sourced from PubChem (CID 130611164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).