N-(2-prop-2-enoxyethyl)cyclohexanamine

C11H21NO — CID 62571605

IUPACN-(2-prop-2-enoxyethyl)cyclohexanamine
SMILESC=CCOCCNC1CCCCC1
InChIInChI=1S/C11H21NO/c1-2-9-13-10-8-12-11-6-4-3-5-7-11/h2,11-12H,1,3-10H2
InChIKeyWMSOSHNCXYAQFI-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.11
Rot. Bonds6

About N-(2-prop-2-enoxyethyl)cyclohexanamine

N-(2-prop-2-enoxyethyl)cyclohexanamine (PubChem CID 62571605) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-(2-prop-2-enoxyethyl)cyclohexanamine.

Molecular Properties

Compound NameN-(2-prop-2-enoxyethyl)cyclohexanamine
PubChem CID62571605
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-(2-prop-2-enoxyethyl)cyclohexanamine
SMILESC=CCOCCNC1CCCCC1
InChIInChI=1S/C11H21NO/c1-2-9-13-10-8-12-11-6-4-3-5-7-11/h2,11-12H,1,3-10H2
InChIKeyWMSOSHNCXYAQFI-UHFFFAOYSA-N
XLogP2.11
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2-prop-2-enoxyethyl)cyclohexanamine?
The IUPAC name of N-(2-prop-2-enoxyethyl)cyclohexanamine (CID 62571605) is N-(2-prop-2-enoxyethyl)cyclohexanamine.
What is the SMILES notation for N-(2-prop-2-enoxyethyl)cyclohexanamine?
The canonical SMILES for N-(2-prop-2-enoxyethyl)cyclohexanamine is C=CCOCCNC1CCCCC1.
What is the InChIKey of N-(2-prop-2-enoxyethyl)cyclohexanamine?
The InChIKey is WMSOSHNCXYAQFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-2-9-13-10-8-12-11-6-4-3-5-7-11/h2,11-12H,1,3-10H2.
What are the key properties of N-(2-prop-2-enoxyethyl)cyclohexanamine?
N-(2-prop-2-enoxyethyl)cyclohexanamine has a molecular weight of 183.29 g/mol, XLogP of 2.11, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-prop-2-enoxyethyl)cyclohexanamine is sourced from PubChem (CID 62571605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).