N-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide

C12H22N2O — CID 107529576

IUPACN-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide
SMILESCC(=O)NCCNCC(C1CC1)C1CC1
InChIInChI=1S/C12H22N2O/c1-9(15)14-7-6-13-8-12(10-2-3-10)11-4-5-11/h10-13H,2-8H2,1H3,(H,14,15)
InChIKeyDHLBMQVDUACPEA-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.15
Rot. Bonds7

About N-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide

N-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide (PubChem CID 107529576) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is N-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide
PubChem CID107529576
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC NameN-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide
SMILESCC(=O)NCCNCC(C1CC1)C1CC1
InChIInChI=1S/C12H22N2O/c1-9(15)14-7-6-13-8-12(10-2-3-10)11-4-5-11/h10-13H,2-8H2,1H3,(H,14,15)
InChIKeyDHLBMQVDUACPEA-UHFFFAOYSA-N
XLogP1.15
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.15
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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Related Compounds

N-(2,2-dicyclopropylethyl)propan-1-amine
CID 19374902
N-[2-(1-cyclobutylethylamino)ethyl]acetamide
CID 107530057
N-[2-(2,3,3-trimethylbutylamino)ethyl]acetamide
CID 107529863
2-cyclopropyl-N-[2-(propylamino)ethyl]propanamide
CID 115563513
2,2-dicyclopropyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethanamine
CID 104562462
N-[2-(cyclononylamino)ethyl]acetamide
CID 154969023
2-[[2-(2-acetamidoethylamino)-2-oxoethyl]amino]-2-cyclopropylacetic acid
CID 62696946
N-[2-(ethylamino)ethyl]acetamide;propane
CID 159314545
N-[2-[2-[2-[2-(ethylamino)ethylamino]ethylamino]ethylamino]ethyl]acetamide
CID 88534902
4-[(2-acetamidoethylamino)methyl]cyclohexane-1-carboxylic acid
CID 79532227
2-bromo-N-(2,2-dicyclopropylethyl)-2-methylpropanamide
CID 114328830
tert-butyl N-[2-[(2-cyclopropyl-2-hydroxyethyl)amino]ethyl]carbamate
CID 115630476

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide?
The IUPAC name of N-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide (CID 107529576) is N-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide.
What is the SMILES notation for N-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide?
The canonical SMILES for N-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide is CC(=O)NCCNCC(C1CC1)C1CC1.
What is the InChIKey of N-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide?
The InChIKey is DHLBMQVDUACPEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-9(15)14-7-6-13-8-12(10-2-3-10)11-4-5-11/h10-13H,2-8H2,1H3,(H,14,15).
What are the key properties of N-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide?
N-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide has a molecular weight of 210.32 g/mol, XLogP of 1.15, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,2-dicyclopropylethylamino)ethyl]acetamide is sourced from PubChem (CID 107529576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).