1-N-ethylcyclononane-1,2-diamine

C11H24N2 — CID 123480411

IUPAC1-N-ethylcyclononane-1,2-diamine
SMILESCCNC1CCCCCCCC1N
InChIInChI=1S/C11H24N2/c1-2-13-11-9-7-5-3-4-6-8-10(11)12/h10-11,13H,2-9,12H2,1H3
InChIKeySZIOYKWHORYWKP-UHFFFAOYSA-N
MW184.33 g/mol
LogP2.04
Rot. Bonds2

About 1-N-ethylcyclononane-1,2-diamine

1-N-ethylcyclononane-1,2-diamine (PubChem CID 123480411) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 1-N-ethylcyclononane-1,2-diamine.

Molecular Properties

Compound Name1-N-ethylcyclononane-1,2-diamine
PubChem CID123480411
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name1-N-ethylcyclononane-1,2-diamine
SMILESCCNC1CCCCCCCC1N
InChIInChI=1S/C11H24N2/c1-2-13-11-9-7-5-3-4-6-8-10(11)12/h10-11,13H,2-9,12H2,1H3
InChIKeySZIOYKWHORYWKP-UHFFFAOYSA-N
XLogP2.04
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-1-N-ethylcyclopentane-1,2-diamine
CID 134287800
trans-(1R,2R)-2-N-dodecylcyclohexane-1,2-diamine
CID 158355577
trans-(1R,2R)-2-N-hexylcyclohexane-1,2-diamine;dihydrochloride
CID 139240198
cis-(1R,2S)-2-N-methylcyclohexane-1,2-diamine
CID 55284519
cis-(1R,2S)-2-(ethylamino)cyclohexan-1-ol
CID 28660465
trans-(1S,2S)-2-(ethylamino)cyclohexan-1-ol
CID 28660461
N-ethyl-2-methylcyclohexan-1-amine;hydrochloride
CID 50988234
trans-(1R,2R)-2-N-[(2R)-2-[[(1R,2R)-2-aminocyclohexyl]amino]propyl]cyclohexane-1,2-diamine
CID 69355597
N,2-diethylcycloheptan-1-amine;propan-1-ol
CID 71071624
1-N-ethyl-2-N,2-N-dimethylcyclododecane-1,2-diamine
CID 55192853
2-[(4,4-dimethylpiperidin-1-yl)methyl]-N-ethylcycloheptan-1-amine
CID 62931664
cyclohexanamine;N-ethylcyclohexanamine
CID 22649726

Frequently Asked Questions

What is the IUPAC name of 1-N-ethylcyclononane-1,2-diamine?
The IUPAC name of 1-N-ethylcyclononane-1,2-diamine (CID 123480411) is 1-N-ethylcyclononane-1,2-diamine.
What is the SMILES notation for 1-N-ethylcyclononane-1,2-diamine?
The canonical SMILES for 1-N-ethylcyclononane-1,2-diamine is CCNC1CCCCCCCC1N.
What is the InChIKey of 1-N-ethylcyclononane-1,2-diamine?
The InChIKey is SZIOYKWHORYWKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-2-13-11-9-7-5-3-4-6-8-10(11)12/h10-11,13H,2-9,12H2,1H3.
What are the key properties of 1-N-ethylcyclononane-1,2-diamine?
1-N-ethylcyclononane-1,2-diamine has a molecular weight of 184.33 g/mol, XLogP of 2.04, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-ethylcyclononane-1,2-diamine is sourced from PubChem (CID 123480411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).