N-cyclopropyl-N-ethylprop-2-enamide

C8H13NO — CID 43616584

IUPACN-cyclopropyl-N-ethylprop-2-enamide
SMILESC=CC(=O)N(CC)C1CC1
InChIInChI=1S/C8H13NO/c1-3-8(10)9(4-2)7-5-6-7/h3,7H,1,4-6H2,2H3
InChIKeyCEMZRDGFUCWEFC-UHFFFAOYSA-N
MW139.20 g/mol
LogP1.18
Rot. Bonds3

About N-cyclopropyl-N-ethylprop-2-enamide

N-cyclopropyl-N-ethylprop-2-enamide (PubChem CID 43616584) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is N-cyclopropyl-N-ethylprop-2-enamide.

Molecular Properties

Compound NameN-cyclopropyl-N-ethylprop-2-enamide
PubChem CID43616584
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC NameN-cyclopropyl-N-ethylprop-2-enamide
SMILESC=CC(=O)N(CC)C1CC1
InChIInChI=1S/C8H13NO/c1-3-8(10)9(4-2)7-5-6-7/h3,7H,1,4-6H2,2H3
InChIKeyCEMZRDGFUCWEFC-UHFFFAOYSA-N
XLogP1.18
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

N-cyclopropyl-N-[(2R)-2-hydroxypropyl]prop-2-enamide
CID 166415254
N-[2-[cyclopropyl-(2-hydroxy-2-methylpropyl)amino]-2-oxoethyl]-N-ethylprop-2-enamide
CID 167800664
N-ethyl-N-(1-prop-2-enoylpiperidin-2-yl)prop-2-enamide
CID 54069854
N-benzyl-N-cyclopropylprop-2-enamide
CID 43616578
N-ethyl-N-[(2Z)-3-methoxypenta-2,4-dien-2-yl]cyclopropanamine
CID 143406800
1-cyclopropyl-3-ethyl-3-methyl-1-prop-2-enylurea
CID 116657097
N-ethyl-N-hydroxyprop-2-enamide
CID 19022461
N-(cyanomethyl)-N-cyclohexylprop-2-enamide
CID 102248410
N-ethyl-N-sulfanylprop-2-enamide
CID 154365527
N-ethyl-N-(2-oxoethyl)prop-2-enamide
CID 90459922
3-[cyclopropyl(ethyl)amino]-3-oxopropanoic acid
CID 62231745
N-[2-(azepan-1-yl)ethyl]-N-cyclobutylprop-2-enamide
CID 126827314

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-ethylprop-2-enamide?
The IUPAC name of N-cyclopropyl-N-ethylprop-2-enamide (CID 43616584) is N-cyclopropyl-N-ethylprop-2-enamide.
What is the SMILES notation for N-cyclopropyl-N-ethylprop-2-enamide?
The canonical SMILES for N-cyclopropyl-N-ethylprop-2-enamide is C=CC(=O)N(CC)C1CC1.
What is the InChIKey of N-cyclopropyl-N-ethylprop-2-enamide?
The InChIKey is CEMZRDGFUCWEFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-3-8(10)9(4-2)7-5-6-7/h3,7H,1,4-6H2,2H3.
What are the key properties of N-cyclopropyl-N-ethylprop-2-enamide?
N-cyclopropyl-N-ethylprop-2-enamide has a molecular weight of 139.20 g/mol, XLogP of 1.18, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-ethylprop-2-enamide is sourced from PubChem (CID 43616584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).