N-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium

C15H24N2OV — CID 145472861

IUPACN-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium
SMILESC/N=C/CCN1CCCC1.OCc1ccccc1.[V]
InChIInChI=1S/C8H16N2.C7H8O.V/c1-9-5-4-8-10-6-2-3-7-10;8-6-7-4-2-1-3-5-7;/h5H,2-4,6-8H2,1H3;1-5,8H,6H2;/b9-5+;;
InChIKeyKRIYWQKMIUQAMG-KJDUPKRESA-N
MW299.31 g/mol
LogP2.35
Rot. Bonds4

About N-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium

N-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium (PubChem CID 145472861) has the molecular formula C15H24N2OV and a molecular weight of 299.31 g/mol. Its IUPAC name is N-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium.

Molecular Properties

Compound NameN-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium
PubChem CID145472861
Molecular FormulaC15H24N2OV
Molecular Weight299.31 g/mol
Exact Mass299.13
IUPAC NameN-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium
SMILESC/N=C/CCN1CCCC1.OCc1ccccc1.[V]
InChIInChI=1S/C8H16N2.C7H8O.V/c1-9-5-4-8-10-6-2-3-7-10;8-6-7-4-2-1-3-5-7;/h5H,2-4,6-8H2,1H3;1-5,8H,6H2;/b9-5+;;
InChIKeyKRIYWQKMIUQAMG-KJDUPKRESA-N
XLogP2.35
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.31
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium 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

(2E)-1-phenyl-2-pyrrolidin-1-yliminoethanol
CID 134987510
1-Phenyl-3-(2,3,4,5-tetrahydropyridin-1-ium-1-yl)propan-1-ol
CID 134858640
{3-[(E)-(Butylimino)methyl]phenyl}methanol
CID 16039403
Phenyl-(propylideneamino)methanol
CID 57287082
(E)-1-(1-methylpyrrolidin-2-yl)-N-phenylmethoxymethanimine
CID 59788102
N,N-diethylethanamine;phenylmethanol
CID 66825555
1-Methylpyrrolidine;phenylmethanol
CID 68747429
N,N-dibutylbutan-1-amine;phenylmethanol
CID 70600701
1-(1-methylpyrrolidin-2-yl)-N-phenylmethoxymethanimine
CID 72562457
(Z)-1-(1-methylpyrrolidin-2-yl)-N-phenylmethoxymethanimine
CID 91160321
(4-Fluorophenyl)methanol;1-methylpyrrolidine
CID 144423872
2-Methylimino-1-phenylethanol
CID 151158403

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium?
The IUPAC name of N-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium (CID 145472861) is N-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium.
What is the SMILES notation for N-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium?
The canonical SMILES for N-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium is C/N=C/CCN1CCCC1.OCc1ccccc1.[V].
What is the InChIKey of N-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium?
The InChIKey is KRIYWQKMIUQAMG-KJDUPKRESA-N. The full InChI is InChI=1S/C8H16N2.C7H8O.V/c1-9-5-4-8-10-6-2-3-7-10;8-6-7-4-2-1-3-5-7;/h5H,2-4,6-8H2,1H3;1-5,8H,6H2;/b9-5+;;.
What are the key properties of N-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium?
N-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium has a molecular weight of 299.31 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-pyrrolidin-1-ylpropan-1-imine;phenylmethanol;vanadium is sourced from PubChem (CID 145472861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).