[1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine

C9H18N2O — CID 106660995

IUPAC[1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine
SMILESCC1CN(C2(CN)CC2)CCO1
InChIInChI=1S/C9H18N2O/c1-8-6-11(4-5-12-8)9(7-10)2-3-9/h8H,2-7,10H2,1H3
InChIKeyAUDLMXLGERCRPJ-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.20
Rot. Bonds2

About [1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine

[1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine (PubChem CID 106660995) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is [1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine
PubChem CID106660995
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name[1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine
SMILESCC1CN(C2(CN)CC2)CCO1
InChIInChI=1S/C9H18N2O/c1-8-6-11(4-5-12-8)9(7-10)2-3-9/h8H,2-7,10H2,1H3
InChIKeyAUDLMXLGERCRPJ-UHFFFAOYSA-N
XLogP0.20
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine?
The IUPAC name of [1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine (CID 106660995) is [1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine.
What is the SMILES notation for [1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine?
The canonical SMILES for [1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine is CC1CN(C2(CN)CC2)CCO1.
What is the InChIKey of [1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine?
The InChIKey is AUDLMXLGERCRPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-8-6-11(4-5-12-8)9(7-10)2-3-9/h8H,2-7,10H2,1H3.
What are the key properties of [1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine?
[1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine has a molecular weight of 170.26 g/mol, XLogP of 0.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methylmorpholin-4-yl)cyclopropyl]methanamine is sourced from PubChem (CID 106660995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).