2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide

C13H24N2O2 — CID 114112932

IUPAC2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide
SMILESCOCCC1(CNC(=O)CNCC2CC2)CC1
InChIInChI=1S/C13H24N2O2/c1-17-7-6-13(4-5-13)10-15-12(16)9-14-8-11-2-3-11/h11,14H,2-10H2,1H3,(H,15,16)
InChIKeyXUIIXVMSASDEOY-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.92
Rot. Bonds9

About 2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide

2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide (PubChem CID 114112932) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide
PubChem CID114112932
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide
SMILESCOCCC1(CNC(=O)CNCC2CC2)CC1
InChIInChI=1S/C13H24N2O2/c1-17-7-6-13(4-5-13)10-15-12(16)9-14-8-11-2-3-11/h11,14H,2-10H2,1H3,(H,15,16)
InChIKeyXUIIXVMSASDEOY-UHFFFAOYSA-N
XLogP0.92
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide (CID 114112932) is 2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide is COCCC1(CNC(=O)CNCC2CC2)CC1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide?
The InChIKey is XUIIXVMSASDEOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-17-7-6-13(4-5-13)10-15-12(16)9-14-8-11-2-3-11/h11,14H,2-10H2,1H3,(H,15,16).
What are the key properties of 2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide?
2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide has a molecular weight of 240.35 g/mol, XLogP of 0.92, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[[1-(2-methoxyethyl)cyclopropyl]methyl]acetamide is sourced from PubChem (CID 114112932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).