3-(cyclopropylmethylamino)-N-ethylpropanamide

C9H18N2O — CID 62324185

IUPAC3-(cyclopropylmethylamino)-N-ethylpropanamide
SMILESCCNC(=O)CCNCC1CC1
InChIInChI=1S/C9H18N2O/c1-2-11-9(12)5-6-10-7-8-3-4-8/h8,10H,2-7H2,1H3,(H,11,12)
InChIKeyFOHIFQSCWURLMZ-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.51
Rot. Bonds6

About 3-(cyclopropylmethylamino)-N-ethylpropanamide

3-(cyclopropylmethylamino)-N-ethylpropanamide (PubChem CID 62324185) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 3-(cyclopropylmethylamino)-N-ethylpropanamide.

Molecular Properties

Compound Name3-(cyclopropylmethylamino)-N-ethylpropanamide
PubChem CID62324185
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name3-(cyclopropylmethylamino)-N-ethylpropanamide
SMILESCCNC(=O)CCNCC1CC1
InChIInChI=1S/C9H18N2O/c1-2-11-9(12)5-6-10-7-8-3-4-8/h8,10H,2-7H2,1H3,(H,11,12)
InChIKeyFOHIFQSCWURLMZ-UHFFFAOYSA-N
XLogP0.51
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.51
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-ethyl-3-[(4-hydroxycyclohexyl)methylamino]propanamide
CID 106133439
N-ethyl-3-[(3-hydroxycyclobutyl)methylamino]propanamide
CID 66005260
3-[[2-(4-aminocyclohexyl)acetyl]amino]-N-ethylpropanamide
CID 113411080
3-(2-cyclohexylethylamino)-N-ethylpropanamide
CID 62324401
3-[[2-(cyclopropylamino)-2-oxoethyl]amino]-N-ethylpropanamide
CID 62325687
3-[(1-methylpiperidin-4-yl)methylamino]-N-propylpropanamide
CID 62659463
3-(ethylamino)-N-[(1-ethylpiperidin-4-yl)methyl]propanamide
CID 55121687
3-[2-[2-[2-[[3-(ethylamino)-3-oxopropyl]amino]ethylamino]ethylamino]ethylamino]-N-methylpropanamide
CID 143379058
N-cyclopropyl-3-[[2-(ethylamino)-2-oxoethyl]amino]propanamide
CID 62626302
3-(ethylamino)-N-[(3-hydroxycyclobutyl)methyl]propanamide
CID 66005719
2-cyclopropyl-N-[2-(ethylamino)ethyl]acetamide
CID 62659717
N-tert-butyl-3-[(4-methylcyclohexyl)methylamino]propanamide
CID 112688557

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylmethylamino)-N-ethylpropanamide?
The IUPAC name of 3-(cyclopropylmethylamino)-N-ethylpropanamide (CID 62324185) is 3-(cyclopropylmethylamino)-N-ethylpropanamide.
What is the SMILES notation for 3-(cyclopropylmethylamino)-N-ethylpropanamide?
The canonical SMILES for 3-(cyclopropylmethylamino)-N-ethylpropanamide is CCNC(=O)CCNCC1CC1.
What is the InChIKey of 3-(cyclopropylmethylamino)-N-ethylpropanamide?
The InChIKey is FOHIFQSCWURLMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-2-11-9(12)5-6-10-7-8-3-4-8/h8,10H,2-7H2,1H3,(H,11,12).
What are the key properties of 3-(cyclopropylmethylamino)-N-ethylpropanamide?
3-(cyclopropylmethylamino)-N-ethylpropanamide has a molecular weight of 170.26 g/mol, XLogP of 0.51, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylmethylamino)-N-ethylpropanamide is sourced from PubChem (CID 62324185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).