N-(2-cyclopropylethoxy)methanamine

C6H13NO — CID 105427061

IUPACN-(2-cyclopropylethoxy)methanamine
SMILESCNOCCC1CC1
InChIInChI=1S/C6H13NO/c1-7-8-5-4-6-2-3-6/h6-7H,2-5H2,1H3
InChIKeyLCIXWZFEMKUCCJ-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.94
Rot. Bonds4

About N-(2-cyclopropylethoxy)methanamine

N-(2-cyclopropylethoxy)methanamine (PubChem CID 105427061) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is N-(2-cyclopropylethoxy)methanamine.

Molecular Properties

Compound NameN-(2-cyclopropylethoxy)methanamine
PubChem CID105427061
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC NameN-(2-cyclopropylethoxy)methanamine
SMILESCNOCCC1CC1
InChIInChI=1S/C6H13NO/c1-7-8-5-4-6-2-3-6/h6-7H,2-5H2,1H3
InChIKeyLCIXWZFEMKUCCJ-UHFFFAOYSA-N
XLogP0.94
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[2-(1-ethylpyrrolidin-2-yl)ethoxy]methanamine
CID 117126787
N-[2-(2-cyclopropylethoxy)ethyl]-4-methylpentan-1-amine
CID 106206257
1-(methoxymethyl)-4-[2-[4-(methoxymethyl)cyclohexyl]ethyl]cyclohexane
CID 19899769
6-(2-cyclopropylethoxy)-N-methylhexan-2-amine
CID 106200767
N-(2-cyclopropylethoxymethoxy)acetamide
CID 139698725
2-[4-[2-(methylamino)ethyl]cyclohexyl]ethyl methanesulfonate;hydrochloride
CID 87926703
2-methoxy-N-methyl-1-(4-propylcyclohexyl)ethanamine
CID 79575352
2-cyclopropylethyl 4-(methylamino)butanoate
CID 106202653
1-(2-cyclopropylethyl)-2-(cyclopropylmethyl)hydrazine
CID 91302631
1-(4-butylcyclohexyl)-N-methylmethanamine
CID 43163686
1-(2-ethoxyethyl)-4-(ethoxymethyl)cyclohexane
CID 134545035
1-(2-cyclopropylethoxy)propan-2-amine
CID 106200486

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylethoxy)methanamine?
The IUPAC name of N-(2-cyclopropylethoxy)methanamine (CID 105427061) is N-(2-cyclopropylethoxy)methanamine.
What is the SMILES notation for N-(2-cyclopropylethoxy)methanamine?
The canonical SMILES for N-(2-cyclopropylethoxy)methanamine is CNOCCC1CC1.
What is the InChIKey of N-(2-cyclopropylethoxy)methanamine?
The InChIKey is LCIXWZFEMKUCCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-7-8-5-4-6-2-3-6/h6-7H,2-5H2,1H3.
What are the key properties of N-(2-cyclopropylethoxy)methanamine?
N-(2-cyclopropylethoxy)methanamine has a molecular weight of 115.18 g/mol, XLogP of 0.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylethoxy)methanamine is sourced from PubChem (CID 105427061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).