(1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine

C9H16N2 — CID 163564480

IUPAC(1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine
SMILESC/C=C1/CCC[C@@H](N)/C1=N\C
InChIInChI=1S/C9H16N2/c1-3-7-5-4-6-8(10)9(7)11-2/h3,8H,4-6,10H2,1-2H3/b7-3-,11-9-/t8-/m1/s1
InChIKeyFUAICXNTKBRVHA-FEKXDSFGSA-N
MW152.24 g/mol
LogP1.51
Rot. Bonds

About (1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine

(1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine (PubChem CID 163564480) has the molecular formula C9H16N2 and a molecular weight of 152.24 g/mol. Its IUPAC name is (1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine.

Molecular Properties

Compound Name(1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine
PubChem CID163564480
Molecular FormulaC9H16N2
Molecular Weight152.24 g/mol
Exact Mass152.13
IUPAC Name(1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine
SMILESC/C=C1/CCC[C@@H](N)/C1=N\C
InChIInChI=1S/C9H16N2/c1-3-7-5-4-6-8(10)9(7)11-2/h3,8H,4-6,10H2,1-2H3/b7-3-,11-9-/t8-/m1/s1
InChIKeyFUAICXNTKBRVHA-FEKXDSFGSA-N
XLogP1.51
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

N-cyclohexyl-6-methylhept-5-en-2-imine
CID 11009116
4-(3-diazo-5-methyl-2H-pyridin-6-yl)butan-1-amine
CID 53678689
2,3,5,6,7,8-Hexahydroquinolin-2-ylmethanamine
CID 68110921
4-(3,4-dihydro-2H-pyrrol-5-yl)-3-methylbut-3-en-1-amine
CID 68983224
(3-butylidene-4H-pyridin-2-yl)methanamine
CID 70596861
(E)-4-(3,4-dihydropyridin-2-yl)hex-4-en-1-amine
CID 89188331
(E)-5-(3,4-dihydropyridin-2-yl)hept-5-en-2-amine
CID 89271099
N-methyl-2,3,5,6,7,8-hexahydroquinolin-8-amine
CID 89742668
2-Imino-4-methylcyclohex-3-en-1-amine
CID 91018476
[6-(3-Methylideneoctyl)-2,3-dihydropyridin-2-yl]methanamine
CID 91229717
1-N-ethyl-6-imino-8-methylnon-7-ene-1,5-diamine
CID 91539250
6-(Cyclohexen-1-yl)-2,3,4,5-tetrahydropyridin-2-amine
CID 122664606

Frequently Asked Questions

What is the IUPAC name of (1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine?
The IUPAC name of (1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine (CID 163564480) is (1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine.
What is the SMILES notation for (1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine?
The canonical SMILES for (1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine is C/C=C1/CCC[C@@H](N)/C1=N\C.
What is the InChIKey of (1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine?
The InChIKey is FUAICXNTKBRVHA-FEKXDSFGSA-N. The full InChI is InChI=1S/C9H16N2/c1-3-7-5-4-6-8(10)9(7)11-2/h3,8H,4-6,10H2,1-2H3/b7-3-,11-9-/t8-/m1/s1.
What are the key properties of (1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine?
(1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine has a molecular weight of 152.24 g/mol, XLogP of 1.51, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,3Z)-3-ethylidene-2-methyliminocyclohexan-1-amine is sourced from PubChem (CID 163564480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).