(Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide

C11H18N2O — CID 134479527

IUPAC(Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide
SMILESC/C=C\C(=N/CC)C(=O)NCC1CC1
InChIInChI=1S/C11H18N2O/c1-3-5-10(12-4-2)11(14)13-8-9-6-7-9/h3,5,9H,4,6-8H2,1-2H3,(H,13,14)/b5-3-,12-10+
InChIKeyVEQBSSYKNTZKMD-XIIBSCIISA-N
MW194.28 g/mol
LogP1.55
Rot. Bonds5

About (Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide

(Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide (PubChem CID 134479527) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is (Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide.

Molecular Properties

Compound Name(Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide
PubChem CID134479527
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name(Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide
SMILESC/C=C\C(=N/CC)C(=O)NCC1CC1
InChIInChI=1S/C11H18N2O/c1-3-5-10(12-4-2)11(14)13-8-9-6-7-9/h3,5,9H,4,6-8H2,1-2H3,(H,13,14)/b5-3-,12-10+
InChIKeyVEQBSSYKNTZKMD-XIIBSCIISA-N
XLogP1.55
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

5-amino-N-cyclopropyl-4,5-dimethylpyrrole-2-carboxamide
CID 68087792
N-(2,3-dihydropyridin-6-ylmethyl)pentanamide
CID 91391690
3-prop-1-enyl-5,6,7,8,9,10-hexahydro-1H-1,4-diazecin-2-one
CID 91425388
N-cyclopropyl-2-imino-4-methylpent-3-enamide
CID 123336525
N-[1-(ethylamino)propan-2-yl]-2-methyliminopent-3-enamide
CID 123673961
N-[(Z)-2-methyliminopent-3-enyl]acetamide
CID 124182649
N-propan-2-yl-2H-pyrrole-5-carboxamide
CID 134452772
(Z)-N-(cyclopropylmethyl)-2-iminopent-3-enamide
CID 134479515
(Z)-N-(cyclopropylmethyl)-2-methyliminopent-3-enamide
CID 134479680
(Z)-N-(cyclopropylmethyl)-2-propan-2-yliminopent-3-enamide
CID 134479731
N-(cyclopropylmethyl)-2-methyliminobut-3-enamide
CID 134479764
N-(cyclopropylmethyl)-2-iminobut-3-enamide
CID 134479844

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide?
The IUPAC name of (Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide (CID 134479527) is (Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide.
What is the SMILES notation for (Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide?
The canonical SMILES for (Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide is C/C=C\C(=N/CC)C(=O)NCC1CC1.
What is the InChIKey of (Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide?
The InChIKey is VEQBSSYKNTZKMD-XIIBSCIISA-N. The full InChI is InChI=1S/C11H18N2O/c1-3-5-10(12-4-2)11(14)13-8-9-6-7-9/h3,5,9H,4,6-8H2,1-2H3,(H,13,14)/b5-3-,12-10+.
What are the key properties of (Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide?
(Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide has a molecular weight of 194.28 g/mol, XLogP of 1.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(cyclopropylmethyl)-2-ethyliminopent-3-enamide is sourced from PubChem (CID 134479527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).