2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide

C13H24N6O — CID 143882925

IUPAC2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN/C=C(\N)CCCc1cnc(N)[nH]1
InChIInChI=1S/C13H24N6O/c1-9(2)18-12(20)8-16-6-10(14)4-3-5-11-7-17-13(15)19-11/h6-7,9,16H,3-5,8,14H2,1-2H3,(H,18,20)(H3,15,17,19)/b10-6-
InChIKeyKASRNFMDJIASJL-POHAHGRESA-N
MW280.38 g/mol
LogP0.23
Rot. Bonds8

About 2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide

2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide (PubChem CID 143882925) has the molecular formula C13H24N6O and a molecular weight of 280.38 g/mol. Its IUPAC name is 2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide
PubChem CID143882925
Molecular FormulaC13H24N6O
Molecular Weight280.38 g/mol
Exact Mass280.20
IUPAC Name2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN/C=C(\N)CCCc1cnc(N)[nH]1
InChIInChI=1S/C13H24N6O/c1-9(2)18-12(20)8-16-6-10(14)4-3-5-11-7-17-13(15)19-11/h6-7,9,16H,3-5,8,14H2,1-2H3,(H,18,20)(H3,15,17,19)/b10-6-
InChIKeyKASRNFMDJIASJL-POHAHGRESA-N
XLogP0.23
TPSA121.85 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.38
LogP ≤ 50.23
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Analyze 2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide (CID 143882925) is 2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide is CC(C)NC(=O)CN/C=C(\N)CCCc1cnc(N)[nH]1.
What is the InChIKey of 2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide?
The InChIKey is KASRNFMDJIASJL-POHAHGRESA-N. The full InChI is InChI=1S/C13H24N6O/c1-9(2)18-12(20)8-16-6-10(14)4-3-5-11-7-17-13(15)19-11/h6-7,9,16H,3-5,8,14H2,1-2H3,(H,18,20)(H3,15,17,19)/b10-6-.
What are the key properties of 2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide?
2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide has a molecular weight of 280.38 g/mol, XLogP of 0.23, 8 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(Z)-2-amino-5-(2-amino-1H-imidazol-5-yl)pent-1-enyl]amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 143882925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).