(2S)-2-azidononane

C9H19N3 — CID 102115708

IUPAC(2S)-2-azidononane
SMILESCCCCCCC[C@H](C)N=[N+]=[N-]
InChIInChI=1S/C9H19N3/c1-3-4-5-6-7-8-9(2)11-12-10/h9H,3-8H2,1-2H3/t9-/m0/s1
InChIKeyHXTMUXMGGKYJLB-VIFPVBQESA-N
MW169.27 g/mol
LogP4.05
Rot. Bonds7

About (2S)-2-azidononane

(2S)-2-azidononane (PubChem CID 102115708) has the molecular formula C9H19N3 and a molecular weight of 169.27 g/mol. Its IUPAC name is (2S)-2-azidononane.

Molecular Properties

Compound Name(2S)-2-azidononane
PubChem CID102115708
Molecular FormulaC9H19N3
Molecular Weight169.27 g/mol
Exact Mass169.16
IUPAC Name(2S)-2-azidononane
SMILESCCCCCCC[C@H](C)N=[N+]=[N-]
InChIInChI=1S/C9H19N3/c1-3-4-5-6-7-8-9(2)11-12-10/h9H,3-8H2,1-2H3/t9-/m0/s1
InChIKeyHXTMUXMGGKYJLB-VIFPVBQESA-N
XLogP4.05
TPSA48.76 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'}

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Related Compounds

(2R)-2-azidohexadecane
CID 174670947
(12R)-12-azidotridecan-1-ol
CID 102293443
1,4-diazidopentane
CID 10820774
6,7-diazidododecane
CID 122603304
di(octan-2-yl)diazene
CID 139695075
2,4-diazidopentane
CID 78066525
1-azidododecane-1-sulfinic acid
CID 174505373
1-azidododecane-1-sulfinate
CID 174505372
3-chloro-2-methyltetradecane
CID 63459285
decyl-dimethyl-nonylphosphanium
CID 87732648
(1-octadecanoyloxy-3-undec-10-enoyloxypropan-2-yl) 17-azidooctadecanoate
CID 162405943
1-azidooctadecyl formate
CID 18522841

Frequently Asked Questions

What is the IUPAC name of (2S)-2-azidononane?
The IUPAC name of (2S)-2-azidononane (CID 102115708) is (2S)-2-azidononane.
What is the SMILES notation for (2S)-2-azidononane?
The canonical SMILES for (2S)-2-azidononane is CCCCCCC[C@H](C)N=[N+]=[N-].
What is the InChIKey of (2S)-2-azidononane?
The InChIKey is HXTMUXMGGKYJLB-VIFPVBQESA-N. The full InChI is InChI=1S/C9H19N3/c1-3-4-5-6-7-8-9(2)11-12-10/h9H,3-8H2,1-2H3/t9-/m0/s1.
What are the key properties of (2S)-2-azidononane?
(2S)-2-azidononane has a molecular weight of 169.27 g/mol, XLogP of 4.05, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-azidononane is sourced from PubChem (CID 102115708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).