(4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine

C11H21N3 — CID 126707591

IUPAC(4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine
SMILESCC1C2CC/C(N)=C(/N(C)N)CCC12
InChIInChI=1S/C11H21N3/c1-7-8-3-5-10(12)11(14(2)13)6-4-9(7)8/h7-9H,3-6,12-13H2,1-2H3/b11-10-
InChIKeyLVLNKLQIHWEDRG-KHPPLWFESA-N
MW195.31 g/mol
LogP1.42
Rot. Bonds1

About (4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine

(4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine (PubChem CID 126707591) has the molecular formula C11H21N3 and a molecular weight of 195.31 g/mol. Its IUPAC name is (4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine.

Molecular Properties

Compound Name(4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine
PubChem CID126707591
Molecular FormulaC11H21N3
Molecular Weight195.31 g/mol
Exact Mass195.17
IUPAC Name(4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine
SMILESCC1C2CC/C(N)=C(/N(C)N)CCC12
InChIInChI=1S/C11H21N3/c1-7-8-3-5-10(12)11(14(2)13)6-4-9(7)8/h7-9H,3-6,12-13H2,1-2H3/b11-10-
InChIKeyLVLNKLQIHWEDRG-KHPPLWFESA-N
XLogP1.42
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 51.42
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

(1Z)-2-[amino(methyl)amino]-5-ethyl-8,8-difluorocycloocten-1-amine;ethane
CID 145278390
(1Z)-2-[amino(methyl)amino]-8,8-difluoro-5-methylcycloocten-1-amine;ethane
CID 145278392
(1Z)-2-[amino(methyl)amino]-8,8-difluoro-5-methylcycloocten-1-amine;ethane
CID 153352608
(1Z)-2-[amino(methyl)amino]-5-ethyl-8,8-difluorocycloocten-1-amine
CID 145278391
(1Z)-2-[amino(methyl)amino]-8,8-difluoro-5-methylcycloocten-1-amine
CID 145278393
(1R,4Z,8S,9R)-5-[amino(2,2-dimethylpropyl)amino]-9-(nitrosomethyl)bicyclo[6.1.0]non-4-en-4-amine
CID 126541883
(1Z)-2-[amino(methyl)amino]-8,8-dimethylcyclononen-1-amine
CID 130256645
(1S,4Z,8R,9R)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine
CID 132099508
(7R)-6,12,14-trimethyl-12,13,14-triazatricyclo[9.3.0.05,7]tetradec-1(11)-ene
CID 134313188
2-[Amino(ethyl)amino]-7-ethylcyclohepten-1-amine
CID 139470185
2-[Amino(methyl)amino]-7-methylcyclohepten-1-amine
CID 139470196
2-[Amino(methyl)amino]-7-ethylcyclohepten-1-amine
CID 139470215

Frequently Asked Questions

What is the IUPAC name of (4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine?
The IUPAC name of (4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine (CID 126707591) is (4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine.
What is the SMILES notation for (4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine?
The canonical SMILES for (4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine is CC1C2CC/C(N)=C(/N(C)N)CCC12.
What is the InChIKey of (4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine?
The InChIKey is LVLNKLQIHWEDRG-KHPPLWFESA-N. The full InChI is InChI=1S/C11H21N3/c1-7-8-3-5-10(12)11(14(2)13)6-4-9(7)8/h7-9H,3-6,12-13H2,1-2H3/b11-10-.
What are the key properties of (4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine?
(4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine has a molecular weight of 195.31 g/mol, XLogP of 1.42, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z)-5-[amino(methyl)amino]-9-methylbicyclo[6.1.0]non-4-en-4-amine is sourced from PubChem (CID 126707591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).