N-cyclopropylspiro[4.4]nonan-4-amine

C12H21N — CID 83906412

IUPACN-cyclopropylspiro[4.4]nonan-4-amine
SMILESC1CCC2(C1)CCCC2NC1CC1
InChIInChI=1S/C12H21N/c1-2-8-12(7-1)9-3-4-11(12)13-10-5-6-10/h10-11,13H,1-9H2
InChIKeyIMOBPCWLFSWEBK-UHFFFAOYSA-N
MW179.31 g/mol
LogP2.85
Rot. Bonds2

About N-cyclopropylspiro[4.4]nonan-4-amine

N-cyclopropylspiro[4.4]nonan-4-amine (PubChem CID 83906412) has the molecular formula C12H21N and a molecular weight of 179.31 g/mol. Its IUPAC name is N-cyclopropylspiro[4.4]nonan-4-amine.

Molecular Properties

Compound NameN-cyclopropylspiro[4.4]nonan-4-amine
PubChem CID83906412
Molecular FormulaC12H21N
Molecular Weight179.31 g/mol
Exact Mass179.17
IUPAC NameN-cyclopropylspiro[4.4]nonan-4-amine
SMILESC1CCC2(C1)CCCC2NC1CC1
InChIInChI=1S/C12H21N/c1-2-8-12(7-1)9-3-4-11(12)13-10-5-6-10/h10-11,13H,1-9H2
InChIKeyIMOBPCWLFSWEBK-UHFFFAOYSA-N
XLogP2.85
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.31
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropylspiro[4.4]nonan-4-amine?
The IUPAC name of N-cyclopropylspiro[4.4]nonan-4-amine (CID 83906412) is N-cyclopropylspiro[4.4]nonan-4-amine.
What is the SMILES notation for N-cyclopropylspiro[4.4]nonan-4-amine?
The canonical SMILES for N-cyclopropylspiro[4.4]nonan-4-amine is C1CCC2(C1)CCCC2NC1CC1.
What is the InChIKey of N-cyclopropylspiro[4.4]nonan-4-amine?
The InChIKey is IMOBPCWLFSWEBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N/c1-2-8-12(7-1)9-3-4-11(12)13-10-5-6-10/h10-11,13H,1-9H2.
What are the key properties of N-cyclopropylspiro[4.4]nonan-4-amine?
N-cyclopropylspiro[4.4]nonan-4-amine has a molecular weight of 179.31 g/mol, XLogP of 2.85, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropylspiro[4.4]nonan-4-amine is sourced from PubChem (CID 83906412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).