(Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide

C15H26N2O — CID 106626717

IUPAC(Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide
SMILESCC/C=C(/C)C(=O)N(CC1CCCCN1)C1CC1
InChIInChI=1S/C15H26N2O/c1-3-6-12(2)15(18)17(14-8-9-14)11-13-7-4-5-10-16-13/h6,13-14,16H,3-5,7-11H2,1-2H3/b12-6-
InChIKeyDEAHHUSDEKCSDX-SDQBBNPISA-N
MW250.39 g/mol
LogP2.48
Rot. Bonds5

About (Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide

(Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide (PubChem CID 106626717) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is (Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide.

Molecular Properties

Compound Name(Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide
PubChem CID106626717
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name(Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide
SMILESCC/C=C(/C)C(=O)N(CC1CCCCN1)C1CC1
InChIInChI=1S/C15H26N2O/c1-3-6-12(2)15(18)17(14-8-9-14)11-13-7-4-5-10-16-13/h6,13-14,16H,3-5,7-11H2,1-2H3/b12-6-
InChIKeyDEAHHUSDEKCSDX-SDQBBNPISA-N
XLogP2.48
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 (Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide?
The IUPAC name of (Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide (CID 106626717) is (Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide.
What is the SMILES notation for (Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide?
The canonical SMILES for (Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide is CC/C=C(/C)C(=O)N(CC1CCCCN1)C1CC1.
What is the InChIKey of (Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide?
The InChIKey is DEAHHUSDEKCSDX-SDQBBNPISA-N. The full InChI is InChI=1S/C15H26N2O/c1-3-6-12(2)15(18)17(14-8-9-14)11-13-7-4-5-10-16-13/h6,13-14,16H,3-5,7-11H2,1-2H3/b12-6-.
What are the key properties of (Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide?
(Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide has a molecular weight of 250.39 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-cyclopropyl-2-methyl-N-(piperidin-2-ylmethyl)pent-2-enamide is sourced from PubChem (CID 106626717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).