N-[2-(ethylamino)ethyl]formamide

C5H12N2O — CID 54012560

IUPACN-[2-(ethylamino)ethyl]formamide
SMILESCCNCCNC=O
InChIInChI=1S/C5H12N2O/c1-2-6-3-4-7-5-8/h5-6H,2-4H2,1H3,(H,7,8)
InChIKeyFIDSTRPCHKZPLB-UHFFFAOYSA-N
MW116.16 g/mol
LogP-0.66
Rot. Bonds5

About N-[2-(ethylamino)ethyl]formamide

N-[2-(ethylamino)ethyl]formamide (PubChem CID 54012560) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is N-[2-(ethylamino)ethyl]formamide.

Molecular Properties

Compound NameN-[2-(ethylamino)ethyl]formamide
PubChem CID54012560
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC NameN-[2-(ethylamino)ethyl]formamide
SMILESCCNCCNC=O
InChIInChI=1S/C5H12N2O/c1-2-6-3-4-7-5-8/h5-6H,2-4H2,1H3,(H,7,8)
InChIKeyFIDSTRPCHKZPLB-UHFFFAOYSA-N
XLogP-0.66
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 5-0.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-formamidoethylamino)ethyl]formamide
CID 89321401
N-[2-[2-(propylamino)ethylamino]ethyl]formamide
CID 150221110
N'-but-1-enyl-N-ethylethane-1,2-diamine
CID 146657084
N-[2-[2-(2-aminoethylamino)ethylamino]ethyl]formamide
CID 121459092
ethane;N-pentylformamide
CID 145350301
N-tetracosylformamide
CID 54077607
N-pentacosylformamide
CID 88723962
N,N'-diethylpentane-1,5-diamine
CID 15013244
N-(2-hydrazinylethyl)formamide
CID 89116528
N-ethyl-N'-[9-(ethylamino)nonyl]nonane-1,9-diamine
CID 58260221
2,2-dimethylpropane;ethane;N-ethylformamide
CID 142479182
N-[2-[[(Z)-but-2-en-2-yl]amino]ethyl]formamide
CID 156718256

Frequently Asked Questions

What is the IUPAC name of N-[2-(ethylamino)ethyl]formamide?
The IUPAC name of N-[2-(ethylamino)ethyl]formamide (CID 54012560) is N-[2-(ethylamino)ethyl]formamide.
What is the SMILES notation for N-[2-(ethylamino)ethyl]formamide?
The canonical SMILES for N-[2-(ethylamino)ethyl]formamide is CCNCCNC=O.
What is the InChIKey of N-[2-(ethylamino)ethyl]formamide?
The InChIKey is FIDSTRPCHKZPLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O/c1-2-6-3-4-7-5-8/h5-6H,2-4H2,1H3,(H,7,8).
What are the key properties of N-[2-(ethylamino)ethyl]formamide?
N-[2-(ethylamino)ethyl]formamide has a molecular weight of 116.16 g/mol, XLogP of -0.66, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(ethylamino)ethyl]formamide is sourced from PubChem (CID 54012560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).