ethanamine;ethane;N-ethylpropanamide

C9H24N2O — CID 157433415

IUPACethanamine;ethane;N-ethylpropanamide
SMILESCC.CCN.CCNC(=O)CC
InChIInChI=1S/C5H11NO.C2H7N.C2H6/c1-3-5(7)6-4-2;1-2-3;1-2/h3-4H2,1-2H3,(H,6,7);2-3H2,1H3;1-2H3
InChIKeyBQUVUTBPKMKMNA-UHFFFAOYSA-N
MW176.30 g/mol
LogP1.52
Rot. Bonds2

About ethanamine;ethane;N-ethylpropanamide

ethanamine;ethane;N-ethylpropanamide (PubChem CID 157433415) has the molecular formula C9H24N2O and a molecular weight of 176.30 g/mol. Its IUPAC name is ethanamine;ethane;N-ethylpropanamide.

Molecular Properties

Compound Nameethanamine;ethane;N-ethylpropanamide
PubChem CID157433415
Molecular FormulaC9H24N2O
Molecular Weight176.30 g/mol
Exact Mass176.19
IUPAC Nameethanamine;ethane;N-ethylpropanamide
SMILESCC.CCN.CCNC(=O)CC
InChIInChI=1S/C5H11NO.C2H7N.C2H6/c1-3-5(7)6-4-2;1-2-3;1-2/h3-4H2,1-2H3,(H,6,7);2-3H2,1H3;1-2H3
InChIKeyBQUVUTBPKMKMNA-UHFFFAOYSA-N
XLogP1.52
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.30
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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N,N'-diethylpropanediamide
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N-[2-(aminomethyl)-2-ethylbutyl]propanamide
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2-(2-aminoethoxy)-N-ethylacetamide
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N-(3-aminopropyl)propanamide
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ethane;propanehydrazide
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2-amino-N-ethylacetamide;hydroxy-methyl-oxophosphanium
CID 88711481
1,3-diethylurea;ethane
CID 142885504
[2-(ethylamino)-2-oxoethyl]azanium
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CID 175477494
CID 175477494

Frequently Asked Questions

What is the IUPAC name of ethanamine;ethane;N-ethylpropanamide?
The IUPAC name of ethanamine;ethane;N-ethylpropanamide (CID 157433415) is ethanamine;ethane;N-ethylpropanamide.
What is the SMILES notation for ethanamine;ethane;N-ethylpropanamide?
The canonical SMILES for ethanamine;ethane;N-ethylpropanamide is CC.CCN.CCNC(=O)CC.
What is the InChIKey of ethanamine;ethane;N-ethylpropanamide?
The InChIKey is BQUVUTBPKMKMNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO.C2H7N.C2H6/c1-3-5(7)6-4-2;1-2-3;1-2/h3-4H2,1-2H3,(H,6,7);2-3H2,1H3;1-2H3.
What are the key properties of ethanamine;ethane;N-ethylpropanamide?
ethanamine;ethane;N-ethylpropanamide has a molecular weight of 176.30 g/mol, XLogP of 1.52, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethanamine;ethane;N-ethylpropanamide is sourced from PubChem (CID 157433415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).