(6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine

C13H26N2 — CID 166948933

IUPAC(6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine
SMILESC=C(CC(C)C/C(N)=C\CC)NC(C)C
InChIInChI=1S/C13H26N2/c1-6-7-13(14)9-11(4)8-12(5)15-10(2)3/h7,10-11,15H,5-6,8-9,14H2,1-4H3/b13-7+
InChIKeyHCZGLMLQHYSCHR-NTUHNPAUSA-N
MW210.36 g/mol
LogP3.17
Rot. Bonds7

About (6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine

(6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine (PubChem CID 166948933) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is (6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine.

Molecular Properties

Compound Name(6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine
PubChem CID166948933
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name(6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine
SMILESC=C(CC(C)C/C(N)=C\CC)NC(C)C
InChIInChI=1S/C13H26N2/c1-6-7-13(14)9-11(4)8-12(5)15-10(2)3/h7,10-11,15H,5-6,8-9,14H2,1-4H3/b13-7+
InChIKeyHCZGLMLQHYSCHR-NTUHNPAUSA-N
XLogP3.17
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(Z)-hex-3-en-3-amine
CID 18331654
(3E)-N-propan-2-ylhexa-1,3-dien-2-amine
CID 126487478
3-ethoxy-N-propan-2-ylprop-1-en-2-amine
CID 143768351
N-propan-2-yldec-1-en-2-amine
CID 166755614
molecular hydrogen;N-propan-2-ylhex-1-en-2-amine
CID 170740409
(3E,5Z)-7-methyl-N-propan-2-ylocta-3,5-dien-4-amine
CID 143792641
1-[(3Z)-5-methylhexa-3,5-dien-2-yl]piperidine;propane
CID 142206747
(3E)-2-methylhexa-1,3-dien-3-amine
CID 130242711
2,3,5-trimethylocta-1,5-diene
CID 123730712
(Z)-4,7-dimethyl-6-methylideneoct-3-ene
CID 143694445
(Z)-5-methylidenehept-3-en-4-amine
CID 162685549
4-aminopent-4-en-2-ol
CID 88961101

Frequently Asked Questions

What is the IUPAC name of (6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine?
The IUPAC name of (6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine (CID 166948933) is (6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine.
What is the SMILES notation for (6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine?
The canonical SMILES for (6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine is C=C(CC(C)C/C(N)=C\CC)NC(C)C.
What is the InChIKey of (6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine?
The InChIKey is HCZGLMLQHYSCHR-NTUHNPAUSA-N. The full InChI is InChI=1S/C13H26N2/c1-6-7-13(14)9-11(4)8-12(5)15-10(2)3/h7,10-11,15H,5-6,8-9,14H2,1-4H3/b13-7+.
What are the key properties of (6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine?
(6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine has a molecular weight of 210.36 g/mol, XLogP of 3.17, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6E)-4-methyl-2-N-propan-2-ylnona-1,6-diene-2,6-diamine is sourced from PubChem (CID 166948933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).