N-pentan-2-ylspiro[3.5]nonan-3-amine

C14H27N — CID 102951172

IUPACN-pentan-2-ylspiro[3.5]nonan-3-amine
SMILESCCCC(C)NC1CCC12CCCCC2
InChIInChI=1S/C14H27N/c1-3-7-12(2)15-13-8-11-14(13)9-5-4-6-10-14/h12-13,15H,3-11H2,1-2H3
InChIKeyVNBDNABEHULPAI-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.88
Rot. Bonds4

About N-pentan-2-ylspiro[3.5]nonan-3-amine

N-pentan-2-ylspiro[3.5]nonan-3-amine (PubChem CID 102951172) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is N-pentan-2-ylspiro[3.5]nonan-3-amine.

Molecular Properties

Compound NameN-pentan-2-ylspiro[3.5]nonan-3-amine
PubChem CID102951172
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC NameN-pentan-2-ylspiro[3.5]nonan-3-amine
SMILESCCCC(C)NC1CCC12CCCCC2
InChIInChI=1S/C14H27N/c1-3-7-12(2)15-13-8-11-14(13)9-5-4-6-10-14/h12-13,15H,3-11H2,1-2H3
InChIKeyVNBDNABEHULPAI-UHFFFAOYSA-N
XLogP3.88
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-pentan-2-ylspiro[3.5]nonan-3-amine?
The IUPAC name of N-pentan-2-ylspiro[3.5]nonan-3-amine (CID 102951172) is N-pentan-2-ylspiro[3.5]nonan-3-amine.
What is the SMILES notation for N-pentan-2-ylspiro[3.5]nonan-3-amine?
The canonical SMILES for N-pentan-2-ylspiro[3.5]nonan-3-amine is CCCC(C)NC1CCC12CCCCC2.
What is the InChIKey of N-pentan-2-ylspiro[3.5]nonan-3-amine?
The InChIKey is VNBDNABEHULPAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-3-7-12(2)15-13-8-11-14(13)9-5-4-6-10-14/h12-13,15H,3-11H2,1-2H3.
What are the key properties of N-pentan-2-ylspiro[3.5]nonan-3-amine?
N-pentan-2-ylspiro[3.5]nonan-3-amine has a molecular weight of 209.38 g/mol, XLogP of 3.88, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-2-ylspiro[3.5]nonan-3-amine is sourced from PubChem (CID 102951172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).