2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine

C11H20N2 — CID 123495440

IUPAC2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine
SMILESCC(C)C1C=C/C(=N/CCN)CC1
InChIInChI=1S/C11H20N2/c1-9(2)10-3-5-11(6-4-10)13-8-7-12/h3,5,9-10H,4,6-8,12H2,1-2H3/b13-11-
InChIKeyNJZNFELLZGOMRL-QBFSEMIESA-N
MW180.29 g/mol
LogP2.01
Rot. Bonds3

About 2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine

2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine (PubChem CID 123495440) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is 2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine.

Molecular Properties

Compound Name2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine
PubChem CID123495440
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC Name2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine
SMILESCC(C)C1C=C/C(=N/CCN)CC1
InChIInChI=1S/C11H20N2/c1-9(2)10-3-5-11(6-4-10)13-8-7-12/h3,5,9-10H,4,6-8,12H2,1-2H3/b13-11-
InChIKeyNJZNFELLZGOMRL-QBFSEMIESA-N
XLogP2.01
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 52.01
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

2-[[4-(1,1,1-Trifluoropropan-2-yl)cyclohex-2-en-1-ylidene]amino]pent-3-yn-1-amine
CID 123477171
(5Z)-10-methyl-2,3,7,8,9,10-hexahydrocycloocta[b]pyrazine
CID 90785170
2-ethanimidoyl-3-N-(3-methylbutan-2-yl)cyclohept-4-ene-1,3-diimine
CID 91598868
N-methyl-2-[(4-methylcyclohex-2-en-1-ylidene)amino]ethanamine
CID 123142247
2-[(6-Methylcyclohex-2-en-1-ylidene)amino]ethanamine
CID 123211734
1-(5-Imino-6-methylcyclohex-3-en-1-yl)ethanamine
CID 123217836
(4-Propyliminocyclohex-2-en-1-yl)methanamine
CID 123339384
N-ethyl-5,6-dimethylcyclohex-2-en-1-imine
CID 123422569
(4-Butyliminocyclohex-2-en-1-yl)methanamine
CID 123602996
(4-Methyliminocyclohex-2-en-1-yl)methanamine
CID 123703590
2-[(4-Methylcyclohex-2-en-1-ylidene)amino]ethanamine
CID 123719177
N-ethyl-4-(3-methylbutyl)cyclohex-2-en-1-imine
CID 123833497

Frequently Asked Questions

What is the IUPAC name of 2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine?
The IUPAC name of 2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine (CID 123495440) is 2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine.
What is the SMILES notation for 2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine?
The canonical SMILES for 2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine is CC(C)C1C=C/C(=N/CCN)CC1.
What is the InChIKey of 2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine?
The InChIKey is NJZNFELLZGOMRL-QBFSEMIESA-N. The full InChI is InChI=1S/C11H20N2/c1-9(2)10-3-5-11(6-4-10)13-8-7-12/h3,5,9-10H,4,6-8,12H2,1-2H3/b13-11-.
What are the key properties of 2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine?
2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine has a molecular weight of 180.29 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-propan-2-ylcyclohex-2-en-1-ylidene)amino]ethanamine is sourced from PubChem (CID 123495440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).