N-ethyl-4-(methylideneamino)cyclohexan-1-amine

C9H18N2 — CID 177002931

IUPACN-ethyl-4-(methylideneamino)cyclohexan-1-amine
SMILESC=NC1CCC(NCC)CC1
InChIInChI=1S/C9H18N2/c1-3-11-9-6-4-8(10-2)5-7-9/h8-9,11H,2-7H2,1H3
InChIKeyNQFHKSIGFWPWMA-UHFFFAOYSA-N
MW154.26 g/mol
LogP1.61
Rot. Bonds3

About N-ethyl-4-(methylideneamino)cyclohexan-1-amine

N-ethyl-4-(methylideneamino)cyclohexan-1-amine (PubChem CID 177002931) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is N-ethyl-4-(methylideneamino)cyclohexan-1-amine.

Molecular Properties

Compound NameN-ethyl-4-(methylideneamino)cyclohexan-1-amine
PubChem CID177002931
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC NameN-ethyl-4-(methylideneamino)cyclohexan-1-amine
SMILESC=NC1CCC(NCC)CC1
InChIInChI=1S/C9H18N2/c1-3-11-9-6-4-8(10-2)5-7-9/h8-9,11H,2-7H2,1H3
InChIKeyNQFHKSIGFWPWMA-UHFFFAOYSA-N
XLogP1.61
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.61
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-ethylcyclopropanamine;hydrochloride
CID 43810659
N-methyl-4-(methylideneamino)cyclohexan-1-amine
CID 139444737
N-ethylcyclodecanamine
CID 148546213
N-ethylcyclooctanamine
CID 13112621
N-ethylcyclopentanamine;methanol
CID 161343027
ethane;N-ethylcyclohexanamine
CID 144865505
1,3-bis[4-(methylideneamino)cyclohexyl]urea
CID 58025021
(3S)-3-N-ethyl-1-N-methylcyclopentane-1,3-diamine
CID 171100893
N-ethylcyclohept-4-en-1-amine;molecular hydrogen
CID 142575463
N-ethylcyclohexanamine;hydroxylamine
CID 142330095
[4-(ethylamino)cyclohexyl]urea
CID 43653665
1-N-ethyl-4-N-methyl-4-N-prop-2-enylcyclohexane-1,4-diamine
CID 102662655

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(methylideneamino)cyclohexan-1-amine?
The IUPAC name of N-ethyl-4-(methylideneamino)cyclohexan-1-amine (CID 177002931) is N-ethyl-4-(methylideneamino)cyclohexan-1-amine.
What is the SMILES notation for N-ethyl-4-(methylideneamino)cyclohexan-1-amine?
The canonical SMILES for N-ethyl-4-(methylideneamino)cyclohexan-1-amine is C=NC1CCC(NCC)CC1.
What is the InChIKey of N-ethyl-4-(methylideneamino)cyclohexan-1-amine?
The InChIKey is NQFHKSIGFWPWMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-3-11-9-6-4-8(10-2)5-7-9/h8-9,11H,2-7H2,1H3.
What are the key properties of N-ethyl-4-(methylideneamino)cyclohexan-1-amine?
N-ethyl-4-(methylideneamino)cyclohexan-1-amine has a molecular weight of 154.26 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(methylideneamino)cyclohexan-1-amine is sourced from PubChem (CID 177002931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).