(3R)-3-methylazecane

C10H21N — CID 11205898

IUPAC(3R)-3-methylazecane
SMILESC[C@@H]1CCCCCCCNC1
InChIInChI=1S/C10H21N/c1-10-7-5-3-2-4-6-8-11-9-10/h10-11H,2-9H2,1H3/t10-/m1/s1
InChIKeyXAVGEVIBENPYFK-SNVBAGLBSA-N
MW155.28 g/mol
LogP2.57
Rot. Bonds

About (3R)-3-methylazecane

(3R)-3-methylazecane (PubChem CID 11205898) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is (3R)-3-methylazecane.

Molecular Properties

Compound Name(3R)-3-methylazecane
PubChem CID11205898
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name(3R)-3-methylazecane
SMILESC[C@@H]1CCCCCCCNC1
InChIInChI=1S/C10H21N/c1-10-7-5-3-2-4-6-8-11-9-10/h10-11H,2-9H2,1H3/t10-/m1/s1
InChIKeyXAVGEVIBENPYFK-SNVBAGLBSA-N
XLogP2.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (3R)-3-methylazecane?
The IUPAC name of (3R)-3-methylazecane (CID 11205898) is (3R)-3-methylazecane.
What is the SMILES notation for (3R)-3-methylazecane?
The canonical SMILES for (3R)-3-methylazecane is C[C@@H]1CCCCCCCNC1.
What is the InChIKey of (3R)-3-methylazecane?
The InChIKey is XAVGEVIBENPYFK-SNVBAGLBSA-N. The full InChI is InChI=1S/C10H21N/c1-10-7-5-3-2-4-6-8-11-9-10/h10-11H,2-9H2,1H3/t10-/m1/s1.
What are the key properties of (3R)-3-methylazecane?
(3R)-3-methylazecane has a molecular weight of 155.28 g/mol, XLogP of 2.57, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methylazecane is sourced from PubChem (CID 11205898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).