N-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide

C8H12NOP — CID 58065573

IUPACN-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide
SMILESO=C(CCP)NC1=CC=CC1
InChIInChI=1S/C8H12NOP/c10-8(5-6-11)9-7-3-1-2-4-7/h1-3H,4-6,11H2,(H,9,10)
InChIKeyZOGNAUNLRJRUAJ-UHFFFAOYSA-N
MW169.16 g/mol
LogP1.21
Rot. Bonds3

About N-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide

N-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide (PubChem CID 58065573) has the molecular formula C8H12NOP and a molecular weight of 169.16 g/mol. Its IUPAC name is N-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide.

Molecular Properties

Compound NameN-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide
PubChem CID58065573
Molecular FormulaC8H12NOP
Molecular Weight169.16 g/mol
Exact Mass169.07
IUPAC NameN-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide
SMILESO=C(CCP)NC1=CC=CC1
InChIInChI=1S/C8H12NOP/c10-8(5-6-11)9-7-3-1-2-4-7/h1-3H,4-6,11H2,(H,9,10)
InChIKeyZOGNAUNLRJRUAJ-UHFFFAOYSA-N
XLogP1.21
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.16
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-cyclopenta-1,3-dien-1-ylacetamide
CID 12826870
5-Ethenyl-1,3-dihydropyrrol-2-one
CID 19845204
N-cyclopenta-1,3-dien-1-yl-2-methylpropanamide
CID 20078647
N-cyclopenta-1,3-dien-1-ylpropanamide
CID 58065569
N-cyclopenta-1,3-dien-1-ylocta-3,5-dienamide;yttrium
CID 58065578
5-But-1-enyl-1,3-dihydropyrrol-2-one
CID 90800647
N-[(3E,5Z)-hepta-3,5-dien-3-yl]acetamide
CID 126660900
5-ethenyl-3,3-dimethyl-1H-pyrrol-2-one
CID 141232584
N-[(3E)-hexa-3,5-dien-3-yl]acetamide
CID 147673295
N-cyclopenta-1,4-dien-1-ylpropanamide
CID 163533501
N-[(4Z,6Z)-nona-1,4,6,8-tetraen-2-yl]acetamide
CID 166717845
N-cyclopenta-1,3-dien-1-ylocta-3,5-dienamide
CID 58065579

Frequently Asked Questions

What is the IUPAC name of N-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide?
The IUPAC name of N-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide (CID 58065573) is N-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide.
What is the SMILES notation for N-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide?
The canonical SMILES for N-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide is O=C(CCP)NC1=CC=CC1.
What is the InChIKey of N-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide?
The InChIKey is ZOGNAUNLRJRUAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12NOP/c10-8(5-6-11)9-7-3-1-2-4-7/h1-3H,4-6,11H2,(H,9,10).
What are the key properties of N-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide?
N-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide has a molecular weight of 169.16 g/mol, XLogP of 1.21, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopenta-1,3-dien-1-yl-3-phosphanylpropanamide is sourced from PubChem (CID 58065573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).