(1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane

C11H25N3 — CID 163386087

IUPAC(1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane
SMILESCC.CN(N)/C1=C(\N)CCCCCC1
InChIInChI=1S/C9H19N3.C2H6/c1-12(11)9-7-5-3-2-4-6-8(9)10;1-2/h2-7,10-11H2,1H3;1-2H3/b9-8-;
InChIKeyRIMANMDZRTTYDE-UOQXYWCXSA-N
MW199.34 g/mol
LogP2.34
Rot. Bonds1

About (1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane

(1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane (PubChem CID 163386087) has the molecular formula C11H25N3 and a molecular weight of 199.34 g/mol. Its IUPAC name is (1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane.

Molecular Properties

Compound Name(1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane
PubChem CID163386087
Molecular FormulaC11H25N3
Molecular Weight199.34 g/mol
Exact Mass199.20
IUPAC Name(1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane
SMILESCC.CN(N)/C1=C(\N)CCCCCC1
InChIInChI=1S/C9H19N3.C2H6/c1-12(11)9-7-5-3-2-4-6-8(9)10;1-2/h2-7,10-11H2,1H3;1-2H3/b9-8-;
InChIKeyRIMANMDZRTTYDE-UOQXYWCXSA-N
XLogP2.34
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(4Z)-5-[amino(methyl)amino]bicyclo[6.1.0]non-4-en-4-amine;ethane;methoxymethane
CID 153397858
(1Z)-cyclodecene-1,2-diamine
CID 89062858
2-(2-aminocycloocten-1-yl)cycloocten-1-amine
CID 151733576
cyclopropane;1,1-dimethylhydrazine
CID 20503940
azane;cyclohexanone;ethane
CID 174919946
(1Z)-2-hydrazinylcycloocten-1-amine
CID 155747316
cyclotetradecanone;N,N-dimethylmethanamine
CID 174611672
2-(2-aminocyclohexen-1-yl)-2-iminoethanol;ethane
CID 142514478
ethane;2-methanimidoylcyclohexen-1-amine
CID 142160083
ethane;2-ethenylsulfanylcyclohexen-1-amine
CID 164531503
(1Z)-2-[amino(methyl)amino]-5-ethyl-8,8-difluorocycloocten-1-amine
CID 145278391
cyclobutane;ethane
CID 91611118

Frequently Asked Questions

What is the IUPAC name of (1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane?
The IUPAC name of (1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane (CID 163386087) is (1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane.
What is the SMILES notation for (1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane?
The canonical SMILES for (1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane is CC.CN(N)/C1=C(\N)CCCCCC1.
What is the InChIKey of (1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane?
The InChIKey is RIMANMDZRTTYDE-UOQXYWCXSA-N. The full InChI is InChI=1S/C9H19N3.C2H6/c1-12(11)9-7-5-3-2-4-6-8(9)10;1-2/h2-7,10-11H2,1H3;1-2H3/b9-8-;.
What are the key properties of (1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane?
(1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane has a molecular weight of 199.34 g/mol, XLogP of 2.34, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-2-[amino(methyl)amino]cycloocten-1-amine;ethane is sourced from PubChem (CID 163386087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).