N-cyclopropyl-2-imino-4-methylpent-3-enamide

C9H14N2O — CID 123336525

IUPACN-cyclopropyl-2-imino-4-methylpent-3-enamide
SMILES[H]/N=C(\C=C(C)C)C(=O)NC1CC1
InChIInChI=1S/C9H14N2O/c1-6(2)5-8(10)9(12)11-7-3-4-7/h5,7,10H,3-4H2,1-2H3,(H,11,12)/b10-8+
InChIKeyJIEQWODGOZIOAC-CSKARUKUSA-N
MW166.22 g/mol
LogP1.25
Rot. Bonds3

About N-cyclopropyl-2-imino-4-methylpent-3-enamide

N-cyclopropyl-2-imino-4-methylpent-3-enamide (PubChem CID 123336525) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is N-cyclopropyl-2-imino-4-methylpent-3-enamide.

Molecular Properties

Compound NameN-cyclopropyl-2-imino-4-methylpent-3-enamide
PubChem CID123336525
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC NameN-cyclopropyl-2-imino-4-methylpent-3-enamide
SMILES[H]/N=C(\C=C(C)C)C(=O)NC1CC1
InChIInChI=1S/C9H14N2O/c1-6(2)5-8(10)9(12)11-7-3-4-7/h5,7,10H,3-4H2,1-2H3,(H,11,12)/b10-8+
InChIKeyJIEQWODGOZIOAC-CSKARUKUSA-N
XLogP1.25
TPSA52.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-cyclopropyl-2-imino-4-methylpent-3-enamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-amino-N-cyclopropyl-4,5-dimethylpyrrole-2-carboxamide
CID 68087792
5-amino-N-butan-2-yl-4,5-dimethylpyrrole-2-carboxamide
CID 70794845
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-ethyliminopent-3-enamide
CID 134479527
(Z)-N-(cyclopropylmethyl)-2-methyliminopent-3-enamide
CID 134479680
(Z)-N-(cyclopropylmethyl)-2-propan-2-yliminopent-3-enamide
CID 134479731
(Z)-N-(cyclopropylmethyl)-2-iminohex-3-enamide
CID 134479875
(Z)-5-(cyclopropylamino)-4-imino-5-oxopent-2-enimidoyl chloride
CID 144491438
(Z)-4-imino-N-methylpent-2-en-1-amine;N-(2-methylpropyl)acetamide;molecular hydrogen
CID 145282388

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-imino-4-methylpent-3-enamide?
The IUPAC name of N-cyclopropyl-2-imino-4-methylpent-3-enamide (CID 123336525) is N-cyclopropyl-2-imino-4-methylpent-3-enamide.
What is the SMILES notation for N-cyclopropyl-2-imino-4-methylpent-3-enamide?
The canonical SMILES for N-cyclopropyl-2-imino-4-methylpent-3-enamide is [H]/N=C(\C=C(C)C)C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-imino-4-methylpent-3-enamide?
The InChIKey is JIEQWODGOZIOAC-CSKARUKUSA-N. The full InChI is InChI=1S/C9H14N2O/c1-6(2)5-8(10)9(12)11-7-3-4-7/h5,7,10H,3-4H2,1-2H3,(H,11,12)/b10-8+.
What are the key properties of N-cyclopropyl-2-imino-4-methylpent-3-enamide?
N-cyclopropyl-2-imino-4-methylpent-3-enamide has a molecular weight of 166.22 g/mol, XLogP of 1.25, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-imino-4-methylpent-3-enamide is sourced from PubChem (CID 123336525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).