N-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide

C10H20N2O — CID 43363271

IUPACN-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide
SMILESCC(=O)NCCNC(C)C1(C)CC1
InChIInChI=1S/C10H20N2O/c1-8(10(3)4-5-10)11-6-7-12-9(2)13/h8,11H,4-7H2,1-3H3,(H,12,13)
InChIKeyMYKNIPXXLVDPPR-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.90
Rot. Bonds5

About N-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide

N-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide (PubChem CID 43363271) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is N-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide
PubChem CID43363271
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC NameN-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide
SMILESCC(=O)NCCNC(C)C1(C)CC1
InChIInChI=1S/C10H20N2O/c1-8(10(3)4-5-10)11-6-7-12-9(2)13/h8,11H,4-7H2,1-3H3,(H,12,13)
InChIKeyMYKNIPXXLVDPPR-UHFFFAOYSA-N
XLogP0.90
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide?
The IUPAC name of N-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide (CID 43363271) is N-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide.
What is the SMILES notation for N-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide?
The canonical SMILES for N-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide is CC(=O)NCCNC(C)C1(C)CC1.
What is the InChIKey of N-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide?
The InChIKey is MYKNIPXXLVDPPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-8(10(3)4-5-10)11-6-7-12-9(2)13/h8,11H,4-7H2,1-3H3,(H,12,13).
What are the key properties of N-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide?
N-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide has a molecular weight of 184.28 g/mol, XLogP of 0.90, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(1-methylcyclopropyl)ethylamino]ethyl]acetamide is sourced from PubChem (CID 43363271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).