carbanide;3-phenylpropanamide;yttrium

C10H14NOY- — CID 160557542

IUPACcarbanide;3-phenylpropanamide;yttrium
SMILESNC(=O)CCc1ccccc1.[CH3-].[Y]
InChIInChI=1S/C9H11NO.CH3.Y/c10-9(11)7-6-8-4-2-1-3-5-8;;/h1-5H,6-7H2,(H2,10,11);1H3;/q;-1;
InChIKeyKZTDHPRJPABZCK-UHFFFAOYSA-N
MW253.13 g/mol
LogP1.55
Rot. Bonds3

About carbanide;3-phenylpropanamide;yttrium

carbanide;3-phenylpropanamide;yttrium (PubChem CID 160557542) has the molecular formula C10H14NOY- and a molecular weight of 253.13 g/mol. Its IUPAC name is carbanide;3-phenylpropanamide;yttrium.

Molecular Properties

Compound Namecarbanide;3-phenylpropanamide;yttrium
PubChem CID160557542
Molecular FormulaC10H14NOY-
Molecular Weight253.13 g/mol
Exact Mass253.01
IUPAC Namecarbanide;3-phenylpropanamide;yttrium
SMILESNC(=O)CCc1ccccc1.[CH3-].[Y]
InChIInChI=1S/C9H11NO.CH3.Y/c10-9(11)7-6-8-4-2-1-3-5-8;;/h1-5H,6-7H2,(H2,10,11);1H3;/q;-1;
InChIKeyKZTDHPRJPABZCK-UHFFFAOYSA-N
XLogP1.55
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.13
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze carbanide;3-phenylpropanamide;yttrium 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

carbonic acid;3-phenylpropanamide
CID 174965682
3-[4-(3-amino-3-oxopropyl)phenyl]propanamide
CID 102388205
3-phenylpropanoyl 3-phenylpropanoate
CID 13024780
lanthanum;3-phenylpropanoic acid
CID 174887955
2-phenylacetamide;3-phenylpropanamide;pyridine-3-carboxamide
CID 69392633
2,6-diaminohexanoic acid;3-phenylpropanamide
CID 174839218
2,3-dioxo-5-phenylpentanoic acid
CID 54131380
7-[5-(3-phenylpropyl)thiophen-2-yl]heptanamide
CID 15667483
2-[2-[4-(3-amino-3-oxopropyl)phenyl]acetyl]benzoic acid
CID 161255029
carbamoyl 3-phenylpropanoate
CID 56614916
N',N'-bis(2-phenylethyl)butanediamide
CID 70184693
3-[4-(2-phenylethyl)phenyl]propanoic acid
CID 54586982

Frequently Asked Questions

What is the IUPAC name of carbanide;3-phenylpropanamide;yttrium?
The IUPAC name of carbanide;3-phenylpropanamide;yttrium (CID 160557542) is carbanide;3-phenylpropanamide;yttrium.
What is the SMILES notation for carbanide;3-phenylpropanamide;yttrium?
The canonical SMILES for carbanide;3-phenylpropanamide;yttrium is NC(=O)CCc1ccccc1.[CH3-].[Y].
What is the InChIKey of carbanide;3-phenylpropanamide;yttrium?
The InChIKey is KZTDHPRJPABZCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO.CH3.Y/c10-9(11)7-6-8-4-2-1-3-5-8;;/h1-5H,6-7H2,(H2,10,11);1H3;/q;-1;.
What are the key properties of carbanide;3-phenylpropanamide;yttrium?
carbanide;3-phenylpropanamide;yttrium has a molecular weight of 253.13 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;3-phenylpropanamide;yttrium is sourced from PubChem (CID 160557542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).