(3E)-N,5-dimethylnona-3,8-dien-4-amine

C11H21N — CID 138564764

IUPAC(3E)-N,5-dimethylnona-3,8-dien-4-amine
SMILESC=CCCC(C)/C(=C\CC)NC
InChIInChI=1S/C11H21N/c1-5-7-9-10(3)11(12-4)8-6-2/h5,8,10,12H,1,6-7,9H2,2-4H3/b11-8+
InChIKeyUZTDWWMGPPXHNW-DHZHZOJOSA-N
MW167.30 g/mol
LogP3.10
Rot. Bonds6

About (3E)-N,5-dimethylnona-3,8-dien-4-amine

(3E)-N,5-dimethylnona-3,8-dien-4-amine (PubChem CID 138564764) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is (3E)-N,5-dimethylnona-3,8-dien-4-amine.

Molecular Properties

Compound Name(3E)-N,5-dimethylnona-3,8-dien-4-amine
PubChem CID138564764
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC Name(3E)-N,5-dimethylnona-3,8-dien-4-amine
SMILESC=CCCC(C)/C(=C\CC)NC
InChIInChI=1S/C11H21N/c1-5-7-9-10(3)11(12-4)8-6-2/h5,8,10,12H,1,6-7,9H2,2-4H3/b11-8+
InChIKeyUZTDWWMGPPXHNW-DHZHZOJOSA-N
XLogP3.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(Z)-N,2-dimethylhex-3-en-3-amine
CID 170980731
(Z)-N,2-dimethylhex-3-en-3-amine;ethane
CID 170980730
5-methyl-6,7-dimethylidenenon-1-ene
CID 142109737
N-methylpropan-1-amine;3-methyl-N-propylhepta-1,6-dien-2-amine
CID 156713243
(6Z)-5-fluoro-6-methylnona-1,6-diene
CID 139323815
methyl (2S)-2-(methylcarbamoylamino)hex-5-enoate
CID 134251298
(E)-9-methyl-4-N-(4-methylpent-1-en-3-yl)-5-N-prop-1-en-2-yldec-3-ene-4,5-diamine
CID 170275071
2-methyloct-7-ene-3,4-diol
CID 103456684
ethane;2-methylbut-1-ene;(3S)-3-methylhepta-1,6-diene
CID 176715177
bis(buta-1,3-diene);5-methylhex-1-ene
CID 174724270
4-(hex-5-en-2-ylamino)pentan-1-ol
CID 104582956
2,3,5-trimethylocta-1,5-diene
CID 123730712

Frequently Asked Questions

What is the IUPAC name of (3E)-N,5-dimethylnona-3,8-dien-4-amine?
The IUPAC name of (3E)-N,5-dimethylnona-3,8-dien-4-amine (CID 138564764) is (3E)-N,5-dimethylnona-3,8-dien-4-amine.
What is the SMILES notation for (3E)-N,5-dimethylnona-3,8-dien-4-amine?
The canonical SMILES for (3E)-N,5-dimethylnona-3,8-dien-4-amine is C=CCCC(C)/C(=C\CC)NC.
What is the InChIKey of (3E)-N,5-dimethylnona-3,8-dien-4-amine?
The InChIKey is UZTDWWMGPPXHNW-DHZHZOJOSA-N. The full InChI is InChI=1S/C11H21N/c1-5-7-9-10(3)11(12-4)8-6-2/h5,8,10,12H,1,6-7,9H2,2-4H3/b11-8+.
What are the key properties of (3E)-N,5-dimethylnona-3,8-dien-4-amine?
(3E)-N,5-dimethylnona-3,8-dien-4-amine has a molecular weight of 167.30 g/mol, XLogP of 3.10, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3E)-N,5-dimethylnona-3,8-dien-4-amine is sourced from PubChem (CID 138564764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).