N-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine

C13H26N2 — CID 62261407

IUPACN-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine
SMILESCCN(CC1(CN)CCCCC1)C1CC1
InChIInChI=1S/C13H26N2/c1-2-15(12-6-7-12)11-13(10-14)8-4-3-5-9-13/h12H,2-11,14H2,1H3
InChIKeyLFLFNXGUNWFPJV-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.38
Rot. Bonds5

About N-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine

N-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine (PubChem CID 62261407) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine.

Molecular Properties

Compound NameN-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine
PubChem CID62261407
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine
SMILESCCN(CC1(CN)CCCCC1)C1CC1
InChIInChI=1S/C13H26N2/c1-2-15(12-6-7-12)11-13(10-14)8-4-3-5-9-13/h12H,2-11,14H2,1H3
InChIKeyLFLFNXGUNWFPJV-UHFFFAOYSA-N
XLogP2.38
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[1-(aminomethyl)cyclopropyl]methyl]-N-ethylcyclohexanamine
CID 115453629
N-[[1-(bromomethyl)cycloheptyl]methyl]-N-ethylcyclopropanamine
CID 65010174
N-[[1-(aminomethyl)cyclopentyl]methyl]-N-(2-methoxyethyl)cyclopropanamine
CID 62259601
N-[[1-(aminomethyl)cyclobutyl]methyl]-N-(2-methylpropyl)cyclopropanamine
CID 115448961
N-[[1-(bromomethyl)cyclobutyl]methyl]-N-ethylcyclohexanamine
CID 65009192
N-ethyl-N-[(3-ethylpiperidin-3-yl)methyl]cyclopropanamine
CID 63133416
N-[(1-aminocyclopentyl)methyl]-N-ethylcyclohexanamine
CID 60852825
N-[[1-(aminomethyl)cyclopentyl]methyl]-N-ethylethanamine
CID 62262051
N-ethyl-N-[(3-propylpiperidin-3-yl)methyl]cyclopropanamine
CID 63133418
1-[[cyclopentyl(ethyl)amino]methyl]cyclopentan-1-amine
CID 60852096
1-(aminomethyl)-N-cyclopropyl-N-ethylcyclooctan-1-amine
CID 43264050
(1-ethylcyclooctyl)methanamine
CID 80604065

Frequently Asked Questions

What is the IUPAC name of N-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine?
The IUPAC name of N-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine (CID 62261407) is N-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine.
What is the SMILES notation for N-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine?
The canonical SMILES for N-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine is CCN(CC1(CN)CCCCC1)C1CC1.
What is the InChIKey of N-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine?
The InChIKey is LFLFNXGUNWFPJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-2-15(12-6-7-12)11-13(10-14)8-4-3-5-9-13/h12H,2-11,14H2,1H3.
What are the key properties of N-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine?
N-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine has a molecular weight of 210.36 g/mol, XLogP of 2.38, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(aminomethyl)cyclohexyl]methyl]-N-ethylcyclopropanamine is sourced from PubChem (CID 62261407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).