nona-3,5-dien-5-amine

C9H17N — CID 173041910

IUPACnona-3,5-dien-5-amine
SMILESCCC=CC(N)=CCCC
InChIInChI=1S/C9H17N/c1-3-5-7-9(10)8-6-4-2/h5,7-8H,3-4,6,10H2,1-2H3
InChIKeyGJKZKXGMKXHZCM-UHFFFAOYSA-N
MW139.24 g/mol
LogP2.60
Rot. Bonds4

About nona-3,5-dien-5-amine

nona-3,5-dien-5-amine (PubChem CID 173041910) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is nona-3,5-dien-5-amine.

Molecular Properties

Compound Namenona-3,5-dien-5-amine
PubChem CID173041910
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Namenona-3,5-dien-5-amine
SMILESCCC=CC(N)=CCCC
InChIInChI=1S/C9H17N/c1-3-5-7-9(10)8-6-4-2/h5,7-8H,3-4,6,10H2,1-2H3
InChIKeyGJKZKXGMKXHZCM-UHFFFAOYSA-N
XLogP2.60
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

(3E,5Z)-nona-3,5-dien-4-amine
CID 146251565
(2Z,4E)-4-methylocta-2,4-dien-1-amine
CID 55285493
(2Z,4Z)-4-aminoocta-2,4-dien-2-ol
CID 142871963
(3Z,5E)-5-propylsulfanylnona-3,5-diene
CID 129267420
(3Z,5E)-5-nitronona-3,5-diene
CID 163823768
(3E,5E,7E)-5-ethyl-7-methylundeca-3,5,7-triene
CID 56936064
(3E,5Z)-4-methylocta-3,5-diene
CID 171633334
(2Z,4E)-1-iminohepta-2,4-dien-3-amine
CID 155149105
(2Z)-nona-2,6-dienamide
CID 87394391
4-[(3Z,5Z)-nona-3,5-dien-5-yl]pyridine
CID 97114967
4-[(3Z,5E)-nona-3,5-dien-5-yl]pyridine
CID 97114966
methyl [(3Z,5E)-nona-3,5-dien-5-yl] carbonate
CID 143778595

Frequently Asked Questions

What is the IUPAC name of nona-3,5-dien-5-amine?
The IUPAC name of nona-3,5-dien-5-amine (CID 173041910) is nona-3,5-dien-5-amine.
What is the SMILES notation for nona-3,5-dien-5-amine?
The canonical SMILES for nona-3,5-dien-5-amine is CCC=CC(N)=CCCC.
What is the InChIKey of nona-3,5-dien-5-amine?
The InChIKey is GJKZKXGMKXHZCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-3-5-7-9(10)8-6-4-2/h5,7-8H,3-4,6,10H2,1-2H3.
What are the key properties of nona-3,5-dien-5-amine?
nona-3,5-dien-5-amine has a molecular weight of 139.24 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for nona-3,5-dien-5-amine is sourced from PubChem (CID 173041910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).