(E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide

C10H15NO — CID 134349428

IUPAC(E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide
SMILESO=C(/C=C/C1CC1)NCC1CC1
InChIInChI=1S/C10H15NO/c12-10(6-5-8-1-2-8)11-7-9-3-4-9/h5-6,8-9H,1-4,7H2,(H,11,12)/b6-5+
InChIKeyPLWMGMCBGZYSHL-AATRIKPKSA-N
MW165.24 g/mol
LogP1.48
Rot. Bonds4

About (E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide

(E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide (PubChem CID 134349428) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is (E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide.

Molecular Properties

Compound Name(E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide
PubChem CID134349428
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name(E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide
SMILESO=C(/C=C/C1CC1)NCC1CC1
InChIInChI=1S/C10H15NO/c12-10(6-5-8-1-2-8)11-7-9-3-4-9/h5-6,8-9H,1-4,7H2,(H,11,12)/b6-5+
InChIKeyPLWMGMCBGZYSHL-AATRIKPKSA-N
XLogP1.48
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide?
The IUPAC name of (E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide (CID 134349428) is (E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide.
What is the SMILES notation for (E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide?
The canonical SMILES for (E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide is O=C(/C=C/C1CC1)NCC1CC1.
What is the InChIKey of (E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide?
The InChIKey is PLWMGMCBGZYSHL-AATRIKPKSA-N. The full InChI is InChI=1S/C10H15NO/c12-10(6-5-8-1-2-8)11-7-9-3-4-9/h5-6,8-9H,1-4,7H2,(H,11,12)/b6-5+.
What are the key properties of (E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide?
(E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide has a molecular weight of 165.24 g/mol, XLogP of 1.48, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-cyclopropyl-N-(cyclopropylmethyl)prop-2-enamide is sourced from PubChem (CID 134349428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).